(2S)-4-methylsulfanyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-4-methylsulfanyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-4-methylsulfanyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2S)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]butanamide IUPAC Name: (2S)-4-methylsulfanyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-N-[4-(2-ketopyrrolidino)benzyl]-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC=C(C=C1)N2CCCC2=O)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CSCC[C@@H](C(=O)NCC1=CC=C(C=C1)N2CCCC2=O)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O4S/c1-32-15-13-21(26-22(28)17-31-20-6-3-2-4-7-20)24(30)25-16-18-9-11-19(12-10-18)27-14-5-8-23(27)29/h2-4,6-7,9-12,21H,5,8,13-17H2,1H3,(H,25,30)(H,26,28)/t21-/m0/s1