Vitas-M small molecule compound
4-{(Z)-[3-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl 3,4-dichloro-1-benzothiophene-2-carboxylate
Catalog ID
STK821778
SMILES S=C1S/C(=C\c2ccc(cc2)OC(=O)c2sc3c(c2Cl)c(Cl)ccc3)/C(=O)N1C1CCS(=O)(=O)C1
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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 C23H15Cl2NO5S4 MW 584.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15Cl2NO5S4/c24-15-2-1-3-16-18(15)19(25)20(33-16)22(28)31-14-6-4-12(5-7-14)10-17-21(27)26(23(32)34-17)13-8-9-35(29,30)11-13/h1-7,10,13H,8-9,11H2/b17-10-InChIKey
YAAOOYSFSCQAJG-YVLHZVERSA-NSynonyms
(4((Z)(3(11DIOXOTHIOLAN3YL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)34DICHLORO1BENZOTHIOPHENE2CARBOXYLATE
4((Z)(3(11dioxidotetrahydrothiophen3yl)4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl34dichloro1benzothiophene2carboxylate
C1CS(=O)(=O)CC1N2C(=O)C(=CC3=CC=C(C=C3)OC(=O)C4=C(C5=C(S4)C=CC=C5Cl)Cl)SC2=S
InChI=1SC23H15Cl2NO5S4c24152131618(15)19(25)20(3316)22(28)31146412(5714)101721(27)26(23(32)3417)138935(2930)1113h171013H8911H2b1710
MFCD03463011
S=C1SC(=Cc2ccc(cc2)OC(=O)c2sc3c(c2Cl)c(Cl)ccc3)C(=O)N1C1CCS(=O)(=O)C1
ZINC000097946975
ZINC000097946976
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