Vitas-M small molecule compound
(2Z)-3-{3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STK881329
SMILES CCSc1ccc(cc1)c1nn(cc1/C=C(\c1nc2c(n1C)cccc2)/C#N)c1ccccc1
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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 C28H23N5S MW 461.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N5S/c1-3-34-24-15-13-20(14-16-24)27-22(19-33(31-27)23-9-5-4-6-10-23)17-21(18-29)28-30-25-11-7-8-12-26(25)32(28)2/h4-17,19H,3H2,1-2H3/b21-17-InChIKey
WNQMGCGVKOSRJF-FXBPSFAMSA-NSynonyms
955866-50-9(2Z)3(3(4(ethylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)2(1methyl1Hbenzimidazol2yl)prop2enenitrile
(Z)3(3(4(ethylthio)phenyl)1phenyl1Hpyrazol4yl)2(1methyl1Hbenzo(d)imidazol2yl)acrylonitrile
(Z)3(3(4ethylsulfanylphenyl)1phenylpyrazol4yl)2(1methylbenzimidazol2yl)prop2enenitrile
955866509
CCSC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C3=NC4=CC=CC=C4N3C)C5=CC=CC=C5
CCSc1ccc(cc1)c1nn(cc1C=C(c1nc2c(n1C)cccc2)C#N)c1ccccc1
InChI=1SC28H23N5Sc133424151320(141624)2722(1933(3127)2395461023)1721(1829)28302511781226(25)32(28)2h41719H3H212H3b2117
MFCD03683951
ZINC000009435231
ZINC09435231
ZINC9435231
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