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

Systemtic Name: diethyl 3-methyl-5-(phenylcarbamothioylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-(phenylcarbamothioylamino)thiophene-2,4-dicarboxylate CAS Name: 5-[[anilino(sulfanylidene)methyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-(phenylcarbamothioylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(phenylthiocarbamoylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H20N2O4S2 MolecularWeight: 392.4924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O4S2/c1-4-23-16(21)13-11(3)14(17(22)24-5-2)26-15(13)20-18(25)19-12-9-7-6-8-10-12/h6-10H,4-5H2,1-3H3,(H2,19,20,25)