methyl 3-[(2-methoxycarbonylthiophen-3-yl)carbamothioylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(2-methoxycarbonylthiophen-3-yl)carbamothioylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(2-methoxycarbonyl-3-thienyl)carbamothioylamino]thiophene-2-carboxylate CAS Name: 3-[[[(2-methoxycarbonyl-3-thiophenyl)amino]-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-methoxycarbonylthiophen-3-yl)carbamothioylamino]thiophene-2-carboxylate Traditional Name: 3-[(2-carbomethoxy-3-thienyl)thiocarbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C13H12N2O4S3 MolecularWeight: 356.44038

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=S)NC2=C(SC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=S)NC2=C(SC=C2)C(=O)OC

InChI

InChI=1S/C13H12N2O4S3/c1-18-11(16)9-7(3-5-21-9)14-13(20)15-8-4-6-22-10(8)12(17)19-2/h3-6H,1-2H3,(H2,14,15,20)