Vitas-M small molecule compound
dimethyl 2-{1-chloro-2-[(2-hydroxyphenyl)amino]-2-thioxoethylidene}-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK692644
SMILES COC(=O)C1=C(S/C(=C(\C(=S)Nc2ccccc2O)/Cl)/S1)C(=O)OC
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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 C15H12ClNO5S3 MW 417.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12ClNO5S3/c1-21-13(19)10-11(14(20)22-2)25-15(24-10)9(16)12(23)17-7-5-3-4-6-8(7)18/h3-6,18H,1-2H3,(H,17,23)InChIKey
VRYGXZUVQGDWAL-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC(=C(C(=S)NC2=CC=CC=C2O)Cl)S1)C(=O)OC
COC(=O)C1=C(SC(=C(C(=S)Nc2ccccc2O)Cl)S1)C(=O)OC
dimethyl2(1chloro2((2hydroxyphenyl)amino)2thioxoethylidene)13dithiole45dicarboxylate
DIMETHYL2(1CHLORO2((2HYDROXYPHENYL)AMINO)2THIOXOETHYLIDENE)15DICARBOXYLATE
dimethyl2(1chloro2(2hydroxyanilino)2sulfanylideneethylidene)13dithiole45dicarboxylate
InChI=1SC15H12ClNO5S3c12113(19)1011(14(20)222)2515(2410)9(16)12(23)17753468(7)18h3618H12H3(H1723)
MFCD10038693
ZINC000015084441
ZINC15084441
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