Vitas-M small molecule compound
(2E)-2-cyano-3-{2-[(2-cyanobenzyl)oxy]naphthalen-1-yl}-N-(3-methoxyphenyl)prop-2-enamide
Catalog ID
STK178791
SMILES N#C/C(=C\c1c(OCc2ccccc2C#N)ccc2c1cccc2)/C(=O)Nc1cccc(c1)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 C29H21N3O3 MW 459.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21N3O3/c1-34-25-11-6-10-24(16-25)32-29(33)23(18-31)15-27-26-12-5-4-7-20(26)13-14-28(27)35-19-22-9-3-2-8-21(22)17-30/h2-16H,19H2,1H3,(H,32,33)/b23-15+InChIKey
JXRKKOREDQQQIG-HZHRSRAPSA-NSynonyms
(2E)2CYANO3(2((2CYANOBENZYL)OXY)NAPHTHALEN1YL)N(3METHOXYPHENYL)PROP2ENAMIDE
(2E)2CYANO3(2((2CYANOPHENYL)METHOXY)NAPHTHYL)N(3METHOXYPHENYL)PROP2ENAMIDE
(E)2CYANO3(2((2CYANOPHENYL)METHOXY)NAPHTHALEN1YL)N(3METHOXYPHENYL)PROP2ENAMIDE
COC1=CC=CC(=C1)NC(=O)C(=CC2=C(C=CC3=CC=CC=C32)OCC4=CC=CC=C4C#N)C#N
InChI=1SC29H21N3O3c134251161024(1625)3229(33)23(1831)1527261254720(26)131428(27)351922932821(22)1730h216H19H21H3(H3233)b2315+
MFCD03649435
N#CC(=Cc1c(OCc2ccccc2C#N)ccc2c1cccc2)C(=O)Nc1cccc(c1)OC
ZINC000008721945
ZINC08721945
ZINC8721945
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