[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-ethyl] 4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoate CAS Name: 4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanoic acid [2-(1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxoethyl] 4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoate Traditional Name: 4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyric acid [2-(1H-indol-3-yl)-2-keto-ethyl] ester Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)C1=CNC2=CC=CC=C21)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CSCCC(C(=O)OCC(=O)C1=CNC2=CC=CC=C21)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5S/c1-31-12-11-20(25-22(27)15-29-16-7-3-2-4-8-16)23(28)30-14-21(26)18-13-24-19-10-6-5-9-17(18)19/h2-10,13,20,24H,11-12,14-15H2,1H3,(H,25,27)