methyl 5-phenyl-2-(phenylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-phenyl-2-(phenylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 5-phenyl-2-(phenylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 2-[[anilino(sulfanylidene)methyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-phenyl-2-(phenylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-phenyl-2-(phenylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C19H16N2O2S2 MolecularWeight: 368.47254

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C19H16N2O2S2/c1-23-18(22)15-12-16(13-8-4-2-5-9-13)25-17(15)21-19(24)20-14-10-6-3-7-11-14/h2-12H,1H3,(H2,20,21,24)