Vitas-M small molecule compound
(2E)-2-cyano-N-(3,4-dimethylphenyl)-3-{1-[2-(morpholin-4-yl)-2-oxoethyl]-1H-indol-3-yl}prop-2-enamide
Catalog ID
STK183198
SMILES N#C/C(=C\c1cn(c2c1cccc2)CC(=O)N1CCOCC1)/C(=O)Nc1ccc(c(c1)C)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 C26H26N4O3 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O3/c1-18-7-8-22(13-19(18)2)28-26(32)20(15-27)14-21-16-30(24-6-4-3-5-23(21)24)17-25(31)29-9-11-33-12-10-29/h3-8,13-14,16H,9-12,17H2,1-2H3,(H,28,32)/b20-14+InChIKey
XOTPGPQOAUNLDT-XSFVSMFZSA-NSynonyms
(2E)2CYANON(34DIMETHYLPHENYL)3(1(2(MORPHOLIN4YL)2OXOETHYL)1HINDOL3YL)PROP2ENAMIDE
(E)2CYANON(34DIMETHYLPHENYL)3(1(2MORPHOLIN4YL2OXOETHYL)INDOL3YL)PROP2ENAMIDE
CC1=C(C=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)N4CCOCC4)C#N)C
InChI=1SC26H26N4O3c1187822(1319(18)2)2826(32)20(1527)14211630(24643523(21)24)1725(31)2991133121029h38131416H91217H212H3(H2832)b2014+
MFCD03249139
N#CC(=Cc1cn(c2c1cccc2)CC(=O)N1CCOCC1)C(=O)Nc1ccc(c(c1)C)C
ZINC000001095479
ZINC01095479
ZINC1095479
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