(2S)-N-[(2S)-1-(3-azanylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(2S)-1-(3-azanylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-2-(3-aminopropylamino)-1-benzyl-2-oxo-ethyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(2S)-1-(3-aminopropylamino)-1-oxo-3-phenylpropan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(2S)-1-(3-aminopropylamino)-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-2-(3-aminopropylamino)-1-benzyl-2-keto-ethyl]pyrrolidine-2-carboxamide Formula: C17H26N4O2 MolecularWeight: 318.41394

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCCN

Isomeric SMILES

C1C[C@H](NC1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCCN

InChI

InChI=1S/C17H26N4O2/c18-9-5-11-20-16(22)15(12-13-6-2-1-3-7-13)21-17(23)14-8-4-10-19-14/h1-3,6-7,14-15,19H,4-5,8-12,18H2,(H,20,22)(H,21,23)/t14-,15-/m0/s1