methyl 3-(naphthalen-1-ylcarbamothioylcarbamoyl)benzoate

Systemtic Name: methyl 3-(naphthalen-1-ylcarbamothioylcarbamoyl)benzoate Openeye Name: methyl 3-(1-naphthylcarbamothioylcarbamoyl)benzoate CAS Name: 3-[[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-(naphthalen-1-ylcarbamothioylcarbamoyl)benzoate Traditional Name: 3-(1-naphthylthiocarbamoylcarbamoyl)benzoic acid methyl ester Formula: C20H16N2O3S MolecularWeight: 364.41764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C20H16N2O3S/c1-25-19(24)15-9-4-8-14(12-15)18(23)22-20(26)21-17-11-5-7-13-6-2-3-10-16(13)17/h2-12H,1H3,(H2,21,22,23,26)