Vitas-M small molecule compound
N-[(1Z)-1-{1-cyano-2-[(4-methoxybenzyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-4-methoxybenzamide
Catalog ID
STK716317
SMILES COc1ccc(cc1)CNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccc(cc1)OC)/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 C27H22N4O4 MW 466.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O4/c1-34-19-11-7-17(8-12-19)16-29-27(33)23(15-28)24-21-5-3-4-6-22(21)25(30-24)31-26(32)18-9-13-20(35-2)14-10-18/h3-14H,16H2,1-2H3,(H,29,33)(H,30,31,32)/b24-23-InChIKey
QMBSNNMYTNCDIW-VHXPQNKSSA-NSynonyms
885184-98-5(Z)N(1(1cyano2((4methoxybenzyl)amino)2oxoethylidene)1Hisoindol3yl)4methoxybenzamide
885184985
COC1=CC=C(C=C1)CNC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(C=C4)OC)C#N
COc1ccc(cc1)CNC(=O)C(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1)OC)C#N
InChI=1SC27H22N4O4c1341911717(81219)162927(33)23(1528)2421534622(21)25(3024)3126(32)1891320(352)141018h314H16H212H3(H2933)(H303132)b2423
MFCD06610352
N((1Z)1(1cyano2((4methoxybenzyl)amino)2oxoethylidene)1Hisoindol3yl)4methoxybenzamide
N((3Z)3(1CYANO2((4METHOXYPHENYL)METHYLAMINO)2OXOETHYLIDENE)ISOINDOL1YL)4METHOXYBENZAMIDE
ZINC000002348609
ZINC02348609
ZINC2348609
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