Vitas-M small molecule compound
4-tert-butyl-N-[(1Z)-1-{1-cyano-2-[(2-methoxyethyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide
Catalog ID
STK829154
SMILES COCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C(C)(C)C)/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 C25H26N4O3 MW 430.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O3/c1-25(2,3)17-11-9-16(10-12-17)23(30)29-22-19-8-6-5-7-18(19)21(28-22)20(15-26)24(31)27-13-14-32-4/h5-12H,13-14H2,1-4H3,(H,27,31)(H,28,29,30)/b21-20-InChIKey
AOLGYCGXBHEIKC-MRCUWXFGSA-NSynonyms
885183-54-0(Z)4(tertbutyl)N(1(1cyano2((2methoxyethyl)amino)2oxoethylidene)1Hisoindol3yl)benzamide
4tertbutylN((1Z)1(1cyano2((2methoxyethyl)amino)2oxoethylidene)1Hisoindol3yl)benzamide
4tertbutylN((3Z)3(1cyano2(2methoxyethylamino)2oxoethylidene)isoindol1yl)benzamide
885183540
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC(=C(C#N)C(=O)NCCOC)C3=CC=CC=C32
COCCNC(=O)C(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C(C)(C)C)C#N
InChI=1SC25H26N4O3c125(23)1711916(101217)23(30)292219865718(19)21(2822)20(1526)24(31)271314324h512H1314H214H3(H2731)(H282930)b2120
MFCD06776449
ZINC000009453229
ZINC09453229
ZINC9453229
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