[2-(1,2-diphenylethylamino)-2-oxidanylidene-ethyl] 3-(methylsulfinylmethyl)benzoate

Systemtic Name: [2-(1,2-diphenylethylamino)-2-oxidanylidene-ethyl] 3-(methylsulfinylmethyl)benzoate Openeye Name: [2-(1,2-diphenylethylamino)-2-oxo-ethyl] 3-(methylsulfinylmethyl)benzoate CAS Name: 3-(methylsulfinylmethyl)benzoic acid [2-(1,2-diphenylethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,2-diphenylethylamino)-2-oxoethyl] 3-(methylsulfinylmethyl)benzoate Traditional Name: 3-(methylsulfinylmethyl)benzoic acid [2-(1,2-diphenylethylamino)-2-keto-ethyl] ester Formula: C25H25NO4S MolecularWeight: 435.5353

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC1=CC=CC(=C1)C(=O)OCC(=O)NC(CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)CC1=CC=CC(=C1)C(=O)OCC(=O)NC(CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H25NO4S/c1-31(29)18-20-11-8-14-22(15-20)25(28)30-17-24(27)26-23(21-12-6-3-7-13-21)16-19-9-4-2-5-10-19/h2-15,23H,16-18H2,1H3,(H,26,27)