diethyl 5-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[(4-chloro-2,5-dimethoxy-phenyl)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(4-chloro-2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(4-chloro-2,5-dimethoxyphenyl)carbamothioylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(4-chloro-2,5-dimethoxy-phenyl)thiocarbamoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H23ClN2O6S2 MolecularWeight: 486.98942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC2=CC(=C(C=C2OC)Cl)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC2=CC(=C(C=C2OC)Cl)OC

InChI

InChI=1S/C20H23ClN2O6S2/c1-6-28-18(24)15-10(3)16(19(25)29-7-2)31-17(15)23-20(30)22-12-9-13(26-4)11(21)8-14(12)27-5/h8-9H,6-7H2,1-5H3,(H2,22,23,30)