[1-oxidanylidene-1-[(4-piperidin-1-ylphenyl)amino]propan-2-yl] 2-ethylsulfanylbenzoate

Systemtic Name: [1-oxidanylidene-1-[(4-piperidin-1-ylphenyl)amino]propan-2-yl] 2-ethylsulfanylbenzoate Openeye Name: [1-methyl-2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 2-ethylsulfanylbenzoate CAS Name: 2-(ethylthio)benzoic acid [1-oxo-1-[4-(1-piperidinyl)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-piperidin-1-ylanilino)propan-2-yl] 2-ethylsulfanylbenzoate Traditional Name: 2-(ethylthio)benzoic acid [2-keto-1-methyl-2-(4-piperidinoanilino)ethyl] ester Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)OC(C)C(=O)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)OC(C)C(=O)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C23H28N2O3S/c1-3-29-21-10-6-5-9-20(21)23(27)28-17(2)22(26)24-18-11-13-19(14-12-18)25-15-7-4-8-16-25/h5-6,9-14,17H,3-4,7-8,15-16H2,1-2H3,(H,24,26)