Vitas-M small molecule compound

2-chloro-N-[(1Z)-1-{1-cyano-2-[(4-methylbenzyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide

Catalog ID
STK579795
SMILES N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1Cl)/C(=O)NCc1ccc(cc1)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 C26H19ClN4O2 MW 454.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19ClN4O2/c1-16-10-12-17(13-11-16)15-29-25(32)21(14-28)23-18-6-2-3-7-19(18)24(30-23)31-26(33)20-8-4-5-9-22(20)27/h2-13H,15H2,1H3,(H,29,32)(H,30,31,33)/b23-21-
InChIKey
GGBRAROTTYKWKB-LNVKXUELSA-N
Synonyms
900890-80-4
(Z)2chloroN(1(1cyano2((4methylbenzyl)amino)2oxoethylidene)1Hisoindol3yl)benzamide
2chloroN((1Z)1(1cyano2((4methylbenzyl)amino)2oxoethylidene)1Hisoindol3yl)benzamide
2CHLORON((3Z)3(1CYANO2((4METHYLPHENYL)METHYLAMINO)2OXOETHYLIDENE)ISOINDOL1YL)BENZAMIDE
900890804
CC1=CC=C(C=C1)CNC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=CC=C4Cl)C#N
InChI=1SC26H19ClN4O2c116101217(131116)152925(32)21(1428)2318623719(18)24(3023)3126(33)20845922(20)27h213H15H21H3(H2932)(H303133)b2321
MFCD06776903
N#CC(=C1N=C(c2c1cccc2)NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(cc1)C
ZINC000009486906
ZINC09486906
ZINC9486906

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Available files

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