Vitas-M small molecule compound
(2Z)-2-(5-methoxy-1H-benzimidazol-2-yl)-3-[4-(methylsulfanyl)phenyl]prop-2-enenitrile
Catalog ID
STL381464
SMILES N#C/C(=C/c1ccc(cc1)SC)/c1nc2c([nH]1)ccc(c2)OC
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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 C18H15N3OS MW 321.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3OS/c1-22-14-5-8-16-17(10-14)21-18(20-16)13(11-19)9-12-3-6-15(23-2)7-4-12/h3-10H,1-2H3,(H,20,21)/b13-9-InChIKey
WBTYKACUZJSTEJ-LCYFTJDESA-NSynonyms
(2Z)2(5methoxy1Hbenzimidazol2yl)3(4(methylsulfanyl)phenyl)prop2enenitrile
(Z)2(6METHOXY1HBENZIMIDAZOL2YL)3(4METHYLSULFANYLPHENYL)PROP2ENENITRILE
COC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=C(C=C3)SC)C#N
InChI=1SC18H15N3OSc12214581617(1014)2118(2016)13(1119)9123615(232)7412h310H12H3(H2021)b139
MFCD06002179
N#CC(=Cc1ccc(cc1)SC)c1nc2c((nH)1)ccc(c2)OC
ZINC000005028308
ZINC05028308
ZINC5028308
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