[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 4-(dimethylamino)benzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 4-(dimethylamino)benzoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 4-(dimethylamino)benzoate CAS Name: 4-(dimethylamino)benzoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 4-(dimethylamino)benzoate Traditional Name: 4-(dimethylamino)benzoic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C20H24N2O3S MolecularWeight: 372.48116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)OCC(=O)NCCCSC2=CC=CC=C2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)OCC(=O)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C20H24N2O3S/c1-22(2)17-11-9-16(10-12-17)20(24)25-15-19(23)21-13-6-14-26-18-7-4-3-5-8-18/h3-5,7-12H,6,13-15H2,1-2H3,(H,21,23)