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

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Openeye Name: [2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 2-[(2-methylthiazol-4-yl)methylsulfanyl]benzoate CAS Name: 2-[(2-methyl-4-thiazolyl)methylthio]benzoic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Traditional Name: 2-[(2-methylthiazol-4-yl)methylthio]benzoic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester Formula: C25H27N3O3S2 MolecularWeight: 481.63018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=CC=C2C(=O)OCC(=O)NC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=CC=C2C(=O)OCC(=O)NC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C25H27N3O3S2/c1-18-26-20(16-32-18)17-33-23-8-4-3-7-22(23)25(30)31-15-24(29)27-19-9-11-21(12-10-19)28-13-5-2-6-14-28/h3-4,7-12,16H,2,5-6,13-15,17H2,1H3,(H,27,29)