S-[2-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]carbamoyl]phenyl] benzenecarbothioate

Systemtic Name: S-[2-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]carbamoyl]phenyl] benzenecarbothioate Openeye Name: S-[2-[[2-(isopropylamino)-2-oxo-ethyl]carbamoyl]phenyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[oxo-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]methyl]phenyl] ester IUPAC Name: S-[2-[[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]phenyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[[2-(isopropylamino)-2-keto-ethyl]carbamoyl]phenyl] ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C1=CC=CC=C1SC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)CNC(=O)C1=CC=CC=C1SC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H20N2O3S/c1-13(2)21-17(22)12-20-18(23)15-10-6-7-11-16(15)25-19(24)14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,20,23)(H,21,22)