S-[2-[[2-oxidanylidene-2-(propylamino)ethyl]carbamoyl]phenyl] 2-methylbenzenecarbothioate

Systemtic Name: S-[2-[[2-oxidanylidene-2-(propylamino)ethyl]carbamoyl]phenyl] 2-methylbenzenecarbothioate Openeye Name: S-[2-[[2-oxo-2-(propylamino)ethyl]carbamoyl]phenyl] 2-methylbenzenecarbothioate CAS Name: 2-methylbenzenecarbothioic acid S-[2-[oxo-[[2-oxo-2-(propylamino)ethyl]amino]methyl]phenyl] ester IUPAC Name: S-[2-[[2-oxo-2-(propylamino)ethyl]carbamoyl]phenyl] 2-methylbenzenecarbothioate Traditional Name: 2-methylthiobenzoic acid S-[2-[[2-keto-2-(propylamino)ethyl]carbamoyl]phenyl] ester Formula: C20H22N2O3S MolecularWeight: 370.46528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)C1=CC=CC=C1SC(=O)C2=CC=CC=C2C

Isomeric SMILES

CCCNC(=O)CNC(=O)C1=CC=CC=C1SC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C20H22N2O3S/c1-3-12-21-18(23)13-22-19(24)16-10-6-7-11-17(16)26-20(25)15-9-5-4-8-14(15)2/h4-11H,3,12-13H2,1-2H3,(H,21,23)(H,22,24)