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Halogenated Heterocycles
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2-Amino-5-chlorobenzoxazole, Activator of K Ca2.2
Cas#: 61-80-3
Compound CID:
6103
Formula:
C7H5ClN2O
Molecular Weight: 168.58
IUPAC Name: 5-chloro-1,3-benzoxazol-2-amine
SMILES: C1=CC2=C(C=C1Cl)N=C(O2)N
InChIKey: YGCODSQDUUUKIV-UHFFFAOYSA-N
InChI: InChI=1S/C7H5ClN2O/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3H,(H2,9,10)
Synonyms: 2-Amino-5-chlorobenzoxazole, 97% | NSC24995 | NSC-24995 | Zoxazolamine [INN:BAN:NF] | GTPL2327 | KBio3_002665 | Spect...
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5-Bromo-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Cas#: 7033-39-8
Compound CID:
81494
Formula:
C6H7BrN2O2
Molecular Weight: 219.04
IUPAC Name: 5-bromo-1,3-dimethylpyrimidine-2,4-dione
SMILES: CN1C=C(C(=O)N(C1=O)C)Br
InChIKey: QITOSXPGCRFMDG-UHFFFAOYSA-N
InChI: InChI=1S/C6H7BrN2O2/c1-8-3-4(7)5(10)9(2)6(8)11/h3H,1-2H3
Synonyms: Uracil, 5-bromo-1,3-dimethyl- | D74897 | 5-Bromo-1,3-dimethyl-1H-pyrimidine-2,4-dione | EN300-269988 | OW45B79UZD | U...
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4,5-Dichlorothiophene-2-sulfonamide
Cas#: 256353-34-1
Compound CID:
3722094
Formula:
C4H3Cl2NO2S2
Molecular Weight: 232.11
IUPAC Name: 4,5-dichlorothiophene-2-sulfonamide
SMILES: C1=C(SC(=C1Cl)Cl)S(=O)(=O)N
InChIKey: JKBNSTFOQDGQLS-UHFFFAOYSA-N
InChI: InChI=1S/C4H3Cl2NO2S2/c5-2-1-3(10-4(2)6)11(7,8)9/h1H,(H2,7,8,9)
Synonyms: J-506941 | CS-W010361 | EN300-1725792 | SCHEMBL1137322 | 2,3-Dichlorothiophene-5-sulfonamide | 4,5-Dichloro-2-thiophe...
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3,4-Difluorobenzamide
Cas#: 85118-04-3
Compound CID:
522832
Formula:
C7H5F2NO
Molecular Weight: 157.12
IUPAC Name: 3,4-difluorobenzamide
SMILES: C1=CC(=C(C=C1C(=O)N)F)F
InChIKey: CMWOHNIHUBDEAG-UHFFFAOYSA-N
InChI: InChI=1S/C7H5F2NO/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H2,10,11)
Synonyms: 3,4-Difluorobenzamide|85118-04-3|MFCD00015549|Benzamide, 3,4-fluoro-|2HO|EINECS 285-656-8|3,4-diflurobenzamide|3,4-Di...
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2-chloro-4-(biphenyl-3-yl)-6-phenyl-1,3,5-triazine
Formula:
C21H14C1N3
Molecular Weight: 343.809
IUPAC Name: 2-chloro-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
SMILES: C1=CC=C(C=C1)C2=CC(=CC=C2)C3=NC(=NC(=N3)C4=CC=CC=C4)Cl
InChIKey: BYPCJJONRMPERB-UHFFFAOYSA-N
InChI: InChI=1S/C21H14ClN3/c22-21-24-19(16-10-5-2-6-11-16)23-20(25-21)18-13-7-12-17(14-18)15-8-3-1-4-9-15/h1-14H
Synonyms: 1689576-03-1 | 2-chloro-4-(biphenyl-3-yl)-6-phenyl-1,3,5-triazine | CS-0095292 | 2-([1,1'-Biphenyl]-3-yl)-4-chloro-6-...
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(Pentafluorophenoxy)acetyl chloride
Cas#: 55502-53-9
Compound CID:
97020
Formula:
C8H2ClF5O2
Molecular Weight: 260.55
IUPAC Name: 2-(2,3,4,5,6-pentafluorophenoxy)acetyl chloride
SMILES: C(C(=O)Cl)OC1=C(C(=C(C(=C1F)F)F)F)F
InChIKey: WQLJMPAQIWVNGS-UHFFFAOYSA-N
InChI: InChI=1S/C8H2ClF5O2/c9-2(15)1-16-8-6(13)4(11)3(10)5(12)7(8)14/h1H2
Synonyms: 2,3,4,5,6-PENTAFLUOROPHENOXYACETYL CHLORIDE | ACETYL CHLORIDE, 2-(2,3,4,5,6-PENTAFLUOROPHENOXY)- | SCHEMBL3026303 | N...
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1H-Pyrrolo[2,3-b]pyridin-4-yltrifluoromethanesulfonate
Cas#: 479552-94-8
Compound CID:
22477395
Formula:
C8H5F3N2O3S
Molecular Weight: 266.2
IUPAC Name: 1H-pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
SMILES: C1=CNC2=NC=CC(=C21)OS(=O)(=O)C(F)(F)F
InChIKey: LRYTVOHQGBBSAZ-UHFFFAOYSA-N
InChI: InChI=1S/C8H5F3N2O3S/c9-8(10,11)17(14,15)16-6-2-4-13-7-5(6)1-3-12-7/h1-4H,(H,12,13)
Synonyms: 1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate | MFCD09763669 | DTXSID90625963 | 1H-Pyrrolo[2,3-b]pyridin-4-...
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2,6-Dichloro-3-(trifluoromethyl)pyridine
Cas#: 55304-75-1
Compound CID:
1810337
Formula:
C6H2Cl2F3N
Molecular Weight: 215.99
IUPAC Name: 2,6-dichloro-3-(trifluoromethyl)pyridine
SMILES: C1=CC(=NC(=C1C(F)(F)F)Cl)Cl
InChIKey: UPWAAFFFSGQECJ-UHFFFAOYSA-N
InChI: InChI=1S/C6H2Cl2F3N/c7-4-2-1-3(5(8)12-4)6(9,10)11/h1-2H
Synonyms: 2,6-Dichloro-3-trifluoromethylpyridine | 2,6-Dichloro-3-trifluoromethyl-pyridine
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2-(Difluoromethyl)pyridine
Cas#: 114468-01-8
Compound CID:
639501
Formula:
C6H5F2N
Molecular Weight: 129.11
IUPAC Name: 2-(difluoromethyl)pyridine
SMILES: C1=CC=NC(=C1)C(F)F
InChIKey: KUHSAAHTEMAJTF-UHFFFAOYSA-N
InChI: InChI=1S/C6H5F2N/c7-6(8)5-3-1-2-4-9-5/h1-4,6H
Synonyms: 2-(difluoromethyl)pyridine|114468-01-8|pyridine, 2-(difluoromethyl)-|Pyridine, 2-(difluoromethyl)- (9CI)|MFCD11226632...
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2-(Dimethoxymethyl)-6-fluoro-1,8-naphthyridine
Cas#: 1222533-72-3
Compound CID:
49761597
Formula:
C11H11FN2O2
Molecular Weight: 222.22
IUPAC Name: 2-(dimethoxymethyl)-6-fluoro-1,8-naphthyridine
SMILES: COC(C1=NC2=NC=C(C=C2C=C1)F)OC
InChIKey: DAVIBRODJFTHQN-UHFFFAOYSA-N
InChI: InChI=1S/C11H11FN2O2/c1-15-11(16-2)9-4-3-7-5-8(12)6-13-10(7)14-9/h3-6,11H,1-2H3
Synonyms: DTXSID60678401 | 2-(Dimethoxymethyl)-6-fluoro-1,8-naphthyridine, AldrichCPR | 1,8-Naphthyridine, 2-(dimethoxymethyl)-...
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2,3,6-Trifluorobenzylamine
Cas#: 230295-09-7
Compound CID:
2777043
Formula:
C7H6F3N
Molecular Weight: 161.13
IUPAC Name: (2,3,6-trifluorophenyl)methanamine
SMILES: C1=CC(=C(C(=C1F)CN)F)F
InChIKey: ITWONDJIBWNPOK-UHFFFAOYSA-N
InChI: InChI=1S/C7H6F3N/c8-5-1-2-6(9)7(10)4(5)3-11/h1-2H,3,11H2
Synonyms: 2,3,6-Trifluorobenzylamine|230295-09-7|(2,3,6-trifluorophenyl)methanamine|BENZENEMETHANAMINE, 2,3,6-TRIFLUORO-|2,3,6-...
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2-Chloro-7-methoxy-3-methylquinoline
Cas#: 132118-45-7
Compound CID:
15640382
Formula:
C11H10ClNO
Molecular Weight: 207.66
IUPAC Name: 2-chloro-7-methoxy-3-methylquinoline
SMILES: CC1=CC2=C(C=C(C=C2)OC)N=C1Cl
InChIKey: KVBVZTHTUJBHOF-UHFFFAOYSA-N
InChI: InChI=1S/C11H10ClNO/c1-7-5-8-3-4-9(14-2)6-10(8)13-11(7)12/h3-6H,1-2H3
Synonyms: 2-Chloro-7-methoxy-3-methylquinoline|132118-45-7|MFCD09787682|SCHEMBL6033527|DTXSID50576149|KVBVZTHTUJBHOF-UHFFFAOYSA...