Vitas-M small molecule compound
N-[(1Z)-1-{1-cyano-2-[(4-methoxybenzyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-4-methylbenzamide
Catalog ID
STK716314
SMILES N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C)/C(=O)NCc1ccc(cc1)OC
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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 C27H22N4O3 MW 450.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O3/c1-17-7-11-19(12-8-17)26(32)31-25-22-6-4-3-5-21(22)24(30-25)23(15-28)27(33)29-16-18-9-13-20(34-2)14-10-18/h3-14H,16H2,1-2H3,(H,29,33)(H,30,31,32)/b24-23-InChIKey
WKUQELLHXUHOOH-VHXPQNKSSA-NSynonyms
885184-77-0(Z)N(1(1cyano2((4methoxybenzyl)amino)2oxoethylidene)1Hisoindol3yl)4methylbenzamide
885184770
CC1=CC=C(C=C1)C(=O)NC2=NC(=C(C#N)C(=O)NCC3=CC=C(C=C3)OC)C4=CC=CC=C42
InChI=1SC27H22N4O3c11771119(12817)26(32)312522643521(22)24(3025)23(1528)27(33)29161891320(342)141018h314H16H212H3(H2933)(H303132)b2423
MFCD06597066
N#CC(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C)C(=O)NCc1ccc(cc1)OC
N((1Z)1(1cyano2((4methoxybenzyl)amino)2oxoethylidene)1Hisoindol3yl)4methylbenzamide
N((3Z)3(1CYANO2((4METHOXYPHENYL)METHYLAMINO)2OXOETHYLIDENE)ISOINDOL1YL)4METHYLBENZAMIDE
ZINC000002206629
ZINC02206629
ZINC2206629
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