diethyl 3-methyl-5-(thiophen-2-ylmethylcarbamothioylamino)thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-(thiophen-2-ylmethylcarbamothioylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-(2-thienylmethylcarbamothioylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[sulfanylidene-(thiophen-2-ylmethylamino)methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-(thiophen-2-ylmethylcarbamothioylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(2-thenylthiocarbamoylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C17H20N2O4S3 MolecularWeight: 412.5467

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NCC2=CC=CS2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NCC2=CC=CS2

InChI

InChI=1S/C17H20N2O4S3/c1-4-22-15(20)12-10(3)13(16(21)23-5-2)26-14(12)19-17(24)18-9-11-7-6-8-25-11/h6-8H,4-5,9H2,1-3H3,(H2,18,19,24)