[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 4-(2-methylpropoxy)benzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 4-(2-methylpropoxy)benzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 4-isobutoxybenzoate CAS Name: 4-(2-methylpropoxy)benzoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxybenzoic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)OCC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C21H25NO4S/c1-16(2)14-25-18-10-8-17(9-11-18)21(24)26-15-20(23)22-12-13-27-19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3,(H,22,23)