[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-[2,3-bis(oxidanylidene)indol-1-yl]ethanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-[2,3-bis(oxidanylidene)indol-1-yl]ethanoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-(2,3-dioxoindolin-1-yl)acetate CAS Name: 2-(2,3-dioxo-1-indolyl)acetic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-(2,3-dioxoindol-1-yl)acetate Traditional Name: 2-(2,3-diketoindolin-1-yl)acetic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)CN2C3=CC=CC=C3C(=O)C2=O

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)CN2C3=CC=CC=C3C(=O)C2=O

InChI

InChI=1S/C21H20N2O5S/c24-18(22-11-6-12-29-15-7-2-1-3-8-15)14-28-19(25)13-23-17-10-5-4-9-16(17)20(26)21(23)27/h1-5,7-10H,6,11-14H2,(H,22,24)