Vitas-M small molecule compound
ethyl 4-{[(2Z)-2-{1-cyano-2-[(2,6-dimethylphenyl)amino]-2-oxoethylidene}-4-oxo-3-phenyl-1,3-thiazolidin-5-yl]methyl}benzoate
Catalog ID
STK740489
SMILES CCOC(=O)c1ccc(cc1)CC1S/C(=C(\C(=O)Nc2c(C)cccc2C)/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 C30H27N3O4S MW 525.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O4S/c1-4-37-30(36)22-15-13-21(14-16-22)17-25-28(35)33(23-11-6-5-7-12-23)29(38-25)24(18-31)27(34)32-26-19(2)9-8-10-20(26)3/h5-16,25H,4,17H2,1-3H3,(H,32,34)/b29-24-InChIKey
PYYZVHGPAVZYQJ-OLFWJLLRSA-NSynonyms
(E)ethyl4((2(1cyano2((26dimethylphenyl)amino)2oxoethylidene)4oxo3phenylthiazolidin5yl)methyl)benzoate
CCOC(=O)C1=CC=C(C=C1)CC2C(=O)N(C(=C(C#N)C(=O)NC3=C(C=CC=C3C)C)S2)C4=CC=CC=C4
CCOC(=O)c1ccc(cc1)CC1SC(=C(C(=O)Nc2c(C)cccc2C)C#N)N(C1=O)c1ccccc1
ethyl4(((2Z)2(1cyano2((26dimethylphenyl)amino)2oxoethylidene)4oxo3phenyl13thiazolidin5yl)methyl)benzoate
ETHYL4(((2Z)2(1CYANO2(26DIMETHYLANILINO)2OXOETHYLIDENE)4OXO3PHENYL13THIAZOLIDIN5YL)METHYL)BENZOATE
ETHYL4((2((N(26DIMETHYLPHENYL)CARBAMOYL)CYANOMETHYLENE)4OXO3PHENYL13THIAZOLIDIN5YL)METHYL)BENZOATE
InChI=1SC30H27N3O4Sc143730(36)22151321(141622)172528(35)33(23116571223)29(3825)24(1831)27(34)322619(2)981020(26)3h51625H417H213H3(H3234)b2924
MFCD06438328
ZINC000012273778
ZINC000012273779
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