(2S)-N-(2-azanyl-2-oxidanylidene-ethyl)-1-[2-[(phenylmethyl)amino]ethanoyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(2-azanyl-2-oxidanylidene-ethyl)-1-[2-[(phenylmethyl)amino]ethanoyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(2-amino-2-oxo-ethyl)-1-[2-(benzylamino)acetyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-(2-amino-2-oxoethyl)-1-[1-oxo-2-[(phenylmethyl)amino]ethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(2-amino-2-oxoethyl)-1-[2-(benzylamino)acetyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(2-amino-2-keto-ethyl)-1-[2-(benzylamino)acetyl]pyrrolidine-2-carboxamide Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNCC2=CC=CC=C2)C(=O)NCC(=O)N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CNCC2=CC=CC=C2)C(=O)NCC(=O)N

InChI

InChI=1S/C16H22N4O3/c17-14(21)10-19-16(23)13-7-4-8-20(13)15(22)11-18-9-12-5-2-1-3-6-12/h1-3,5-6,13,18H,4,7-11H2,(H2,17,21)(H,19,23)/t13-/m0/s1