[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-indan-5-ylsulfanylacetate CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)acetic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetate Traditional Name: 2-(indan-5-ylthio)acetic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C22H23NO4S/c1-2-21(25)23-18-9-6-16(7-10-18)20(24)13-27-22(26)14-28-19-11-8-15-4-3-5-17(15)12-19/h6-12H,2-5,13-14H2,1H3,(H,23,25)