Vitas-M small molecule compound
(2E)-3-[4-(benzyloxy)-3-methoxyphenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STK287157
SMILES COc1cc(ccc1OCc1ccccc1)/C=C(/c1[nH]c2c(n1)cc(c(c2)C)C)\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 C26H23N3O2 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O2/c1-17-11-22-23(12-18(17)2)29-26(28-22)21(15-27)13-20-9-10-24(25(14-20)30-3)31-16-19-7-5-4-6-8-19/h4-14H,16H2,1-3H3,(H,28,29)/b21-13+InChIKey
MDHIJCVYJJNXCW-FYJGNVAPSA-NSynonyms
(2E)3(4(benzyloxy)3methoxyphenyl)2(56dimethyl1Hbenzimidazol2yl)prop2enenitrile
(E)2(56DIMETHYL1HBENZIMIDAZOL2YL)3(3METHOXY4PHENYLMETHOXYPHENYL)PROP2ENENITRILE
CC1=CC2=C(C=C1C)N=C(N2)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C#N
COc1cc(ccc1OCc1ccccc1)C=C(c1(nH)c2c(n1)cc(c(c2)C)C)C#N
InChI=1SC26H23N3O2c117112223(1218(17)2)2926(2822)21(1527)132091024(25(1420)303)3116197546819h414H16H213H3(H2829)b2113+
MFCD06629331
ZINC000004809701
ZINC04809701
ZINC4809701
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