Vitas-M small molecule compound
(2E)-2-cyano-N-(2,3-dimethylphenyl)-3-{1-[2-oxo-2-(phenylamino)ethyl]-1H-indol-3-yl}prop-2-enamide
Catalog ID
STK182258
SMILES N#C/C(=C\c1cn(c2c1cccc2)CC(=O)Nc1ccccc1)/C(=O)Nc1cccc(c1C)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 C28H24N4O2 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O2/c1-19-9-8-13-25(20(19)2)31-28(34)21(16-29)15-22-17-32(26-14-7-6-12-24(22)26)18-27(33)30-23-10-4-3-5-11-23/h3-15,17H,18H2,1-2H3,(H,30,33)(H,31,34)/b21-15+InChIKey
KWIXSLKMUPKVKI-RCCKNPSSSA-NSynonyms
(2E)2CYANON(23DIMETHYLPHENYL)3(1(2OXO2(PHENYLAMINO)ETHYL)1HINDOL3YL)PROP2ENAMIDE
(E)3(1(2ANILINO2OXOETHYL)INDOL3YL)2CYANON(23DIMETHYLPHENYL)PROP2ENAMIDE
CC1=C(C(=CC=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)NC4=CC=CC=C4)C#N)C
InChI=1SC28H24N4O2c119981325(20(19)2)3128(34)21(1629)15221732(2614761224(22)26)1827(33)3023104351123h31517H18H212H3(H3033)(H3134)b2115+
MFCD02108306
N#CC(=Cc1cn(c2c1cccc2)CC(=O)Nc1ccccc1)C(=O)Nc1cccc(c1C)C
ZINC000001211721
ZINC01211721
ZINC1211721
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