Vitas-M small molecule compound
4-methyl-N-[2,2,2-trichloro-1-(4-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)ethyl]benzamide
Catalog ID
STK822033
SMILES C=CCN1C(=S)S/C(=C\c2ccc(cc2)OC(C(Cl)(Cl)Cl)NC(=O)c2ccc(cc2)C)/C1=O
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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 C23H19Cl3N2O3S2 MW 541.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19Cl3N2O3S2/c1-3-12-28-20(30)18(33-22(28)32)13-15-6-10-17(11-7-15)31-21(23(24,25)26)27-19(29)16-8-4-14(2)5-9-16/h3-11,13,21H,1,12H2,2H3,(H,27,29)/b18-13-InChIKey
KCQRQNMTYBUNJO-AQTBWJFISA-NSynonyms
4methylN(222trichloro1(4((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)phenoxy)ethyl)benzamide
4methylN(222trichloro1(4((Z)(4oxo3prop2enyl2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)ethyl)benzamide
C=CCN1C(=S)SC(=Cc2ccc(cc2)OC(C(Cl)(Cl)Cl)NC(=O)c2ccc(cc2)C)C1=O
CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)OC2=CC=C(C=C2)C=C3C(=O)N(C(=S)S3)CC=C
InChI=1SC23H19Cl3N2O3S2c13122820(30)18(3322(28)32)131561017(11715)3121(23(2425)26)2719(29)168414(2)5916h3111321H112H22H3(H2729)b1813
MFCD03463198
ZINC000097947052
ZINC000097947053
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