Vitas-M small molecule compound
(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(3-chloro-4-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK244839
SMILES COc1ccc(cc1Cl)N1C(=S)S/C(=C/c2ccc3c(c2)OCO3)/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 C18H12ClNO4S2 MW 405.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12ClNO4S2/c1-22-13-5-3-11(8-12(13)19)20-17(21)16(26-18(20)25)7-10-2-4-14-15(6-10)24-9-23-14/h2-8H,9H2,1H3/b16-7+InChIKey
HUQMPRLKCRUENW-FRKPEAEDSA-NSynonyms
(5E)5(13BENZODIOXOL5YLMETHYLIDENE)3(3CHLORO4METHOXYPHENYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(13BENZODIOXOL5YLMETHYLIDENE)3(3CHLORO4METHOXYPHENYL)2THIOXO13THIAZOLIDIN4ONE
COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S)Cl
COc1ccc(cc1Cl)N1C(=S)SC(=Cc2ccc3c(c2)OCO3)C1=O
InChI=1SC18H12ClNO4S2c122135311(812(13)19)2017(21)16(2618(20)25)710241415(610)2492314h28H9H21H3b167+
MFCD03614193
ZINC000006672332
ZINC06672332
ZINC6672332
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