Vitas-M small molecule compound

(2Z)-3-(2-amino-1H-benzimidazol-1-yl)-2-[(3-methylphenyl)carbonyl]prop-2-enenitrile

Catalog ID
STK769223
SMILES N#C/C(=C/n1c(N)nc2c1cccc2)/C(=O)c1cccc(c1)C

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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 C18H14N4O MW 302.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N4O/c1-12-5-4-6-13(9-12)17(23)14(10-19)11-22-16-8-3-2-7-15(16)21-18(22)20/h2-9,11H,1H3,(H2,20,21)/b14-11-
InChIKey
YPXNNDHMSDMBBY-KAMYIIQDSA-N
Synonyms

(2Z)3(2amino1Hbenzimidazol1yl)2((3methylphenyl)carbonyl)prop2enenitrile
(2Z)3(2AMINOBENZIMIDAZOLYL)2((3METHYLPHENYL)CARBONYL)PROP2ENENITRILE
(Z)3(2AMINOBENZIMIDAZOL1YL)2(3METHYLBENZOYL)PROP2ENENITRILE
CC1=CC=CC(=C1)C(=O)C(=CN2C3=CC=CC=C3N=C2N)C#N
InChI=1SC18H14N4Oc11254613(912)17(23)14(1019)112216832715(16)2118(22)20h2911H1H3(H22021)b1411
MFCD03408620
N#CC(=Cn1c(N)nc2c1cccc2)C(=O)c1cccc(c1)C
ZINC000004171288
ZINC04171288
ZINC4171288

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Available files

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