Vitas-M small molecule compound
N-[(1Z)-1-{1-cyano-2-[(4-methylbenzyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-4-methoxybenzamide
Catalog ID
STK716347
SMILES N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)OC)/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 C27H22N4O3 MW 450.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O3/c1-17-7-9-18(10-8-17)16-29-27(33)23(15-28)24-21-5-3-4-6-22(21)25(30-24)31-26(32)19-11-13-20(34-2)14-12-19/h3-14H,16H2,1-2H3,(H,29,33)(H,30,31,32)/b24-23-InChIKey
JEHZMUJHQVPELE-VHXPQNKSSA-NSynonyms
885187-66-6(Z)N(1(1cyano2((4methylbenzyl)amino)2oxoethylidene)1Hisoindol3yl)4methoxybenzamide
885187666
CC1=CC=C(C=C1)CNC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(C=C4)OC)C#N
InChI=1SC27H22N4O3c1177918(10817)162927(33)23(1528)2421534622(21)25(3024)3126(32)19111320(342)141219h314H16H212H3(H2933)(H303132)b2423
MFCD06772378
N#CC(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1)OC)C(=O)NCc1ccc(cc1)C
N((1Z)1(1cyano2((4methylbenzyl)amino)2oxoethylidene)1Hisoindol3yl)4methoxybenzamide
N((3Z)3(1CYANO2((4METHYLPHENYL)METHYLAMINO)2OXOETHYLIDENE)ISOINDOL1YL)4METHOXYBENZAMIDE
ZINC000009328135
ZINC09328135
ZINC9328135
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