[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2-[(4-methylphenyl)methylsulfanyl]ethanoate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2-[(4-methylphenyl)methylsulfanyl]ethanoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-(p-tolylmethylsulfanyl)acetate CAS Name: 2-[(4-methylphenyl)methylthio]acetic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-[(4-methylphenyl)methylsulfanyl]acetate Traditional Name: 2-[(4-methylbenzyl)thio]acetic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CSCC2=CC=C(C=C2)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CSCC2=CC=C(C=C2)C

InChI

InChI=1S/C21H23NO4S/c1-3-20(24)22-18-10-8-17(9-11-18)19(23)12-26-21(25)14-27-13-16-6-4-15(2)5-7-16/h4-11H,3,12-14H2,1-2H3,(H,22,24)