[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Openeye Name: [2-[benzyl(isopropyl)amino]-2-oxo-ethyl] 4-[(2-methylthiazol-4-yl)methylsulfanyl]benzoate CAS Name: 4-[(2-methyl-4-thiazolyl)methylthio]benzoic acid [2-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl] ester IUPAC Name: [2-[benzyl(propan-2-yl)amino]-2-oxoethyl] 4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Traditional Name: 4-[(2-methylthiazol-4-yl)methylthio]benzoic acid [2-[benzyl(isopropyl)amino]-2-keto-ethyl] ester Formula: C24H26N2O3S2 MolecularWeight: 454.60484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)OCC(=O)N(CC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)OCC(=O)N(CC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C24H26N2O3S2/c1-17(2)26(13-19-7-5-4-6-8-19)23(27)14-29-24(28)20-9-11-22(12-10-20)31-16-21-15-30-18(3)25-21/h4-12,15,17H,13-14,16H2,1-3H3