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

Systemtic Name: diethyl 3-methyl-5-(phenethylcarbamothioylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-(phenethylcarbamothioylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(phenethylamino)-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-(phenethylcarbamothioylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(phenethylthiocarbamoylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C20H24N2O4S2/c1-4-25-18(23)15-13(3)16(19(24)26-5-2)28-17(15)22-20(27)21-12-11-14-9-7-6-8-10-14/h6-10H,4-5,11-12H2,1-3H3,(H2,21,22,27)