[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 4-indan-5-yl-4-oxo-butanoate CAS Name: 4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoate Traditional Name: 4-indan-5-yl-4-keto-butyric acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)OCC(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)OCC(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C24H27NO4S/c26-22(20-11-10-18-6-4-7-19(18)16-20)12-13-24(28)29-17-23(27)25-14-5-15-30-21-8-2-1-3-9-21/h1-3,8-11,16H,4-7,12-15,17H2,(H,25,27)