[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-(5-methyl-1,3-dioxo-isoindolin-2-yl)propanoate CAS Name: 2-(5-methyl-1,3-dioxo-2-isoindolyl)propanoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-(5-methyl-1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 2-(1,3-diketo-5-methyl-isoindolin-2-yl)propionic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)C(C)C(=O)OCC(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)C(C)C(=O)OCC(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5S/c1-15-9-10-18-19(13-15)22(28)25(21(18)27)16(2)23(29)30-14-20(26)24-11-6-12-31-17-7-4-3-5-8-17/h3-5,7-10,13,16H,6,11-12,14H2,1-2H3,(H,24,26)