ethyl 2-[[phenethyl-(phenylmethyl)carbamothioyl]amino]benzoate

Systemtic Name: ethyl 2-[[phenethyl-(phenylmethyl)carbamothioyl]amino]benzoate Openeye Name: ethyl 2-[[benzyl(phenethyl)carbamothioyl]amino]benzoate CAS Name: 2-[[[phenethyl-(phenylmethyl)amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[benzyl(phenethyl)carbamothioyl]amino]benzoate Traditional Name: 2-[[benzyl(phenethyl)thiocarbamoyl]amino]benzoic acid ethyl ester Formula: C25H26N2O2S MolecularWeight: 418.55114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=S)N(CCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=S)N(CCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O2S/c1-2-29-24(28)22-15-9-10-16-23(22)26-25(30)27(19-21-13-7-4-8-14-21)18-17-20-11-5-3-6-12-20/h3-16H,2,17-19H2,1H3,(H,26,30)