Vitas-M small molecule compound

(2E)-2-cyano-N-(3-methoxyphenyl)-3-(1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-1H-indol-3-yl)prop-2-enamide

Catalog ID
STK179098
SMILES COc1cccc(c1)NC(=O)/C(=C/c1cn(c2c1cccc2)CC(=O)Nc1ccc(cc1)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 C28H24N4O3 MW 464.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O3/c1-19-10-12-22(13-11-19)30-27(33)18-32-17-21(25-8-3-4-9-26(25)32)14-20(16-29)28(34)31-23-6-5-7-24(15-23)35-2/h3-15,17H,18H2,1-2H3,(H,30,33)(H,31,34)/b20-14+
InChIKey
AHIRQFAWVYKKTC-XSFVSMFZSA-N
Synonyms

(2E)2CYANON(3METHOXYPHENYL)3(1((N(4METHYLPHENYL)CARBAMOYL)METHYL)INDOL3YL)PROP2ENAMIDE
(2E)2CYANON(3METHOXYPHENYL)3(1(2((4METHYLPHENYL)AMINO)2OXOETHYL)1HINDOL3YL)PROP2ENAMIDE
(E)2CYANON(3METHOXYPHENYL)3(1(2(4METHYLANILINO)2OXOETHYL)INDOL3YL)PROP2ENAMIDE
CC1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)NC4=CC(=CC=C4)OC
COc1cccc(c1)NC(=O)C(=Cc1cn(c2c1cccc2)CC(=O)Nc1ccc(cc1)C)C#N
InChI=1SC28H24N4O3c119101222(131119)3027(33)18321721(25834926(25)32)1420(1629)28(34)312365724(1523)352h31517H18H212H3(H3033)(H3134)b2014+
MFCD03834885
ZINC000004090764
ZINC04090764
ZINC4090764

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Available files

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