Vitas-M small molecule compound
3-({[4-ethyl-3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamothioyl}amino)-4-methylbenzoic acid
Catalog ID
STK464968
SMILES COC(=O)c1c(NC(=S)Nc2cc(ccc2C)C(=O)O)sc(c1CC)C
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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 C18H20N2O4S2 MW 392.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4S2/c1-5-12-10(3)26-15(14(12)17(23)24-4)20-18(25)19-13-8-11(16(21)22)7-6-9(13)2/h6-8H,5H2,1-4H3,(H,21,22)(H2,19,20,25)InChIKey
HSDQKHFIWFKJPY-UHFFFAOYSA-NSynonyms
3((((4ETHYL3(METHOXYCARBONYL)5METHYL(2THIENYL))AMINO)THIOXOMETHYL)AMINO)4METHYLBENZOICACID
3(((4ethyl3(methoxycarbonyl)5methylthiophen2yl)carbamothioyl)amino)4methylbenzoicacid
3((4ethyl3methoxycarbonyl5methylthiophen2yl)carbamothioylamino)4methylbenzoicacid
CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2=C(C=CC(=C2)C(=O)O)C)C
InChI=1SC18H20N2O4S2c151210(3)2615(14(12)17(23)244)2018(25)1913811(16(21)22)769(13)2h68H5H214H3(H2122)(H2192025)
MFCD06105337
ZINC000017080189
ZINC17080189
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