Vitas-M small molecule compound
N-(3,4-dimethylphenyl)-2-(4-{(E)-[3-(3,4-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)acetamide
Catalog ID
STL419168
SMILES COc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C)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 C29H28N2O4S2 MW 532.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O4S2/c1-17-6-9-22(12-19(17)3)30-27(32)16-35-24-11-8-21(14-25(24)34-5)15-26-28(33)31(29(36)37-26)23-10-7-18(2)20(4)13-23/h6-15H,16H2,1-5H3,(H,30,32)/b26-15+InChIKey
BQKOPCSHOWGVFE-CVKSISIWSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)C4=CC(=C(C=C4)C)C)OC)C
COc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)C=C1SC(=S)N(C1=O)c1ccc(c(c1)C)C
InChI=1SC29H28N2O4S2c1176922(1219(17)3)3027(32)16352411821(1425(24)345)152628(33)31(29(36)3726)2310718(2)20(4)1323h615H16H215H3(H3032)b2615+
MFCD03614301
N(34DIMETHYLPHENYL)2(4((E)(3(34DIMETHYLPHENYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENOXY)ACETAMIDE
N(34dimethylphenyl)2(4((E)(3(34dimethylphenyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenoxy)acetamide
ZINC000100322987
ZINC100322987
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