Vitas-M small molecule compound
5-amino-3-[(Z)-1-cyano-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Catalog ID
STK374620
SMILES OCCn1nc(c(c1N)C#N)/C(=C/c1ccc2c(c1)n(C)c(=O)n2C)/C#N
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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 C18H17N7O2 MW 363.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N7O2/c1-23-14-4-3-11(8-15(14)24(2)18(23)27)7-12(9-19)16-13(10-20)17(21)25(22-16)5-6-26/h3-4,7-8,26H,5-6,21H2,1-2H3/b12-7+InChIKey
ABTSABXZOFQHLM-KPKJPENVSA-NSynonyms
5amino3((Z)1cyano2(13dimethyl2oxo23dihydro1Hbenzimidazol5yl)ethenyl)1(2hydroxyethyl)1Hpyrazole4carbonitrile
5AMINO3((Z)1CYANO2(13DIMETHYL2OXOBENZIMIDAZOL5YL)ETHENYL)1(2HYDROXYETHYL)PYRAZOLE4CARBONITRILE
CN1C2=C(C=C(C=C2)C=C(C#N)C3=NN(C(=C3C#N)N)CCO)N(C1=O)C
InChI=1SC18H17N7O2c123144311(815(14)24(2)18(23)27)712(919)1613(1020)17(21)25(2216)5626h347826H5621H212H3b127+
MFCD01304323
OCCn1nc(c(c1N)C#N)C(=Cc1ccc2c(c1)n(C)c(=O)n2C)C#N
ZINC000004118908
ZINC04118908
ZINC4118908
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