Vitas-M small molecule compound
4-chloro-N-[(1Z)-1-{1-cyano-2-[(3-methylbutyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide
Catalog ID
STK582111
SMILES N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)/C(=O)NCCC(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 C23H21ClN4O2 MW 420.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN4O2/c1-14(2)11-12-26-23(30)19(13-25)20-17-5-3-4-6-18(17)21(27-20)28-22(29)15-7-9-16(24)10-8-15/h3-10,14H,11-12H2,1-2H3,(H,26,30)(H,27,28,29)/b20-19-InChIKey
RKRRLGYVIICKBS-VXPUYCOJSA-NSynonyms
900894-98-6(Z)4chloroN(1(1cyano2(isopentylamino)2oxoethylidene)1Hisoindol3yl)benzamide
4chloroN((1Z)1(1cyano2((3methylbutyl)amino)2oxoethylidene)1Hisoindol3yl)benzamide
4CHLORON((3Z)3(1CYANO2(3METHYLBUTYLAMINO)2OXOETHYLIDENE)ISOINDOL1YL)BENZAMIDE
900894986
CC(C)CCNC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC=C(C=C3)Cl)C#N
InChI=1SC23H21ClN4O2c114(2)11122623(30)19(1325)2017534618(17)21(2720)2822(29)157916(24)10815h31014H1112H212H3(H2630)(H272829)b2019
MFCD06778327
N#CC(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)C(=O)NCCC(C)C
ZINC000008560456
ZINC08560456
ZINC8560456
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