dimethyl 5-[(2-methoxycarbonylthiophen-3-yl)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[(2-methoxycarbonylthiophen-3-yl)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[(2-methoxycarbonyl-3-thienyl)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[(2-methoxycarbonyl-3-thiophenyl)amino]-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2-methoxycarbonylthiophen-3-yl)carbamothioylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(2-carbomethoxy-3-thienyl)thiocarbamoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C16H16N2O6S3 MolecularWeight: 428.50304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=C(SC=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=C(SC=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H16N2O6S3/c1-7-9(13(19)22-2)12(27-10(7)14(20)23-3)18-16(25)17-8-5-6-26-11(8)15(21)24-4/h5-6H,1-4H3,(H2,17,18,25)