(2S)-N-[(2S)-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-1-oxidanylidene-4-phenyl-butan-2-yl]-6-oxidanylidene-piperidine-2-carboxamide

Systemtic Name: (2S)-N-[(2S)-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-1-oxidanylidene-4-phenyl-butan-2-yl]-6-oxidanylidene-piperidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-1-[(2S)-2-carbamoylpyrrolidine-1-carbonyl]-3-phenyl-propyl]-6-oxo-piperidine-2-carboxamide CAS Name: (2S)-N-[(2S)-1-[(2S)-2-carbamoyl-1-pyrrolidinyl]-1-oxo-4-phenylbutan-2-yl]-6-oxo-2-piperidinecarboxamide IUPAC Name: (2S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxo-4-phenylbutan-2-yl]-6-oxopiperidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-1-[(2S)-2-carbamoylpyrrolidine-1-carbonyl]-3-phenyl-propyl]-6-keto-pipecolinamide Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC(=O)C1)C(=O)NC(CCC2=CC=CC=C2)C(=O)N3CCCC3C(=O)N

Isomeric SMILES

C1C[C@H](NC(=O)C1)C(=O)N[C@@H](CCC2=CC=CC=C2)C(=O)N3CCC[C@H]3C(=O)N

InChI

InChI=1S/C21H28N4O4/c22-19(27)17-9-5-13-25(17)21(29)16(12-11-14-6-2-1-3-7-14)24-20(28)15-8-4-10-18(26)23-15/h1-3,6-7,15-17H,4-5,8-13H2,(H2,22,27)(H,23,26)(H,24,28)/t15-,16-,17-/m0/s1