Vitas-M small molecule compound
(5E)-3-benzyl-5-{3-chloro-4-[3-(2-chlorophenoxy)propoxy]-5-ethoxybenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK094675
SMILES CCOc1cc(/C=C\2/SC(=S)N(C2=O)Cc2ccccc2)cc(c1OCCCOc1ccccc1Cl)Cl
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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 C28H25Cl2NO4S2 MW 574.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25Cl2NO4S2/c1-2-33-24-16-20(17-25-27(32)31(28(36)37-25)18-19-9-4-3-5-10-19)15-22(30)26(24)35-14-8-13-34-23-12-7-6-11-21(23)29/h3-7,9-12,15-17H,2,8,13-14,18H2,1H3/b25-17+InChIKey
PQNHOKCXEYGQNA-KOEQRZSOSA-NSynonyms
(5E)3benzyl5((3chloro4(3(2chlorophenoxy)propoxy)5ethoxyphenyl)methylidene)2sulfanylidene13thiazolidin4one
(5E)3BENZYL5(3CHLORO4(3(2CHLOROPHENOXY)PROPOXY)5ETHOXYBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3)Cl)OCCCOC4=CC=CC=C4Cl
CCOc1cc(C=C2SC(=S)N(C2=O)Cc2ccccc2)cc(c1OCCCOc1ccccc1Cl)Cl
InChI=1SC28H25Cl2NO4S2c1233241620(172527(32)31(28(36)3725)181994351019)1522(30)26(24)3514813342312761121(23)29h379121517H28131418H21H3b2517+
MFCD08672801
STK094675
ZINC000097959256
ZINC97959256
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