Vitas-M small molecule compound
diethyl 5-({[(3-chloro-4-ethoxyphenyl)carbonyl]carbamothioyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK163624
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(c(c2)Cl)OCC)sc(c1C)C(=O)OCC
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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 C21H23ClN2O6S2 MW 499.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN2O6S2/c1-5-28-14-9-8-12(10-13(14)22)17(25)23-21(31)24-18-15(19(26)29-6-2)11(4)16(32-18)20(27)30-7-3/h8-10H,5-7H2,1-4H3,(H2,23,24,25,31)InChIKey
OEILNEIXKGXORG-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)OCC)Cl
DIETHYL5((((3CHLORO4ETHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
DIETHYL5((3CHLORO4ETHOXYBENZOYL)CARBAMOTHIOYLAMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC21H23ClN2O6S2c1528149812(1013(14)22)17(25)2321(31)241815(19(26)2962)11(4)16(3218)20(27)3073h810H57H214H3(H223242531)
MFCD03146652
ZINC000009846217
ZINC09846217
ZINC9846217
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