Vitas-M small molecule compound
(2E)-2-[(4-chlorophenyl)sulfonyl]-3-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)prop-2-enenitrile
Catalog ID
STK697573
SMILES N#C/C(=C\c1ccc2c(c1)n(C)c(=O)n2C)/S(=O)(=O)c1ccc(cc1)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H14ClN3O3S MW 387.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClN3O3S/c1-21-16-8-3-12(10-17(16)22(2)18(21)23)9-15(11-20)26(24,25)14-6-4-13(19)5-7-14/h3-10H,1-2H3/b15-9+InChIKey
JDKIEZRBKWIKSL-OQLLNIDSSA-NSynonyms
938012-65-8(2E)2((4chlorophenyl)sulfonyl)3(13dimethyl2oxo23dihydro1Hbenzimidazol5yl)prop2enenitrile
(E)2((4chlorophenyl)sulfonyl)3(13dimethyl2oxo23dihydro1Hbenzo(d)imidazol5yl)acrylonitrile
(E)2(4chlorophenyl)sulfonyl3(13dimethyl2oxobenzimidazol5yl)prop2enenitrile
938012658
CN1C2=C(C=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl)N(C1=O)C
InChI=1SC18H14ClN3O3Sc121168312(1017(16)22(2)18(21)23)915(1120)26(2425)146413(19)5714h310H12H3b159+
MFCD09476150
N#CC(=Cc1ccc2c(c1)n(C)c(=O)n2C)S(=O)(=O)c1ccc(cc1)Cl
ZINC000012390312
ZINC12390312
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