Vitas-M small molecule compound
methyl 4-{(E)-[(2E)-2-{1-cyano-2-[(3-methylphenyl)amino]-2-oxoethylidene}-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]methyl}benzoate
Catalog ID
STL344053
SMILES COC(=O)c1ccc(cc1)/C=c\1/s/c(=C(/C(=O)Nc2cccc(c2)C)\C#N)/n(c1=O)c1ccccc1
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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 C28H21N3O4S MW 495.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N3O4S/c1-18-7-6-8-21(15-18)30-25(32)23(17-29)27-31(22-9-4-3-5-10-22)26(33)24(36-27)16-19-11-13-20(14-12-19)28(34)35-2/h3-16H,1-2H3,(H,30,32)/b24-16+,27-23+InChIKey
VEXGJSYAJJQFMP-SVOCCOSCSA-NSynonyms
845899-58-3845899583
CC1=CC(=CC=C1)NC(=O)C(=C2N(C(=O)C(=CC3=CC=C(C=C3)C(=O)OC)S2)C4=CC=CC=C4)C#N
COC(=O)c1ccc(cc1)C=c1sc(=C(C(=O)Nc2cccc(c2)C)C#N)n(c1=O)c1ccccc1
InChI=1SC28H21N3O4Sc11876821(1518)3025(32)23(1729)2731(2294351022)26(33)24(3627)1619111320(141219)28(34)352h316H12H3(H3032)b2416+2723+
methyl4((E)((2E)2(1cyano2((3methylphenyl)amino)2oxoethylidene)4oxo3phenyl13thiazolidin5ylidene)methyl)benzoate
METHYL4((E)((2E)2(1CYANO2(3METHYLANILINO)2OXOETHYLIDENE)4OXO3PHENYL13THIAZOLIDIN5YLIDENE)METHYL)BENZOATE
methyl4((E)((E)2(1cyano2oxo2(mtolylamino)ethylidene)4oxo3phenylthiazolidin5ylidene)methyl)benzoate
MFCD04172711
ZINC000009303546
ZINC09303546
ZINC9303546
Check stock
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