1-[4-(2-azanylethanoylamino)pyrrolidin-2-yl]carbonyl-4-[(2-oxidanyl-4-phenyl-butanoyl)amino]-N-quinolin-3-yl-pyrrolidine-2-carboxamide

Systemtic Name: 1-[4-(2-azanylethanoylamino)pyrrolidin-2-yl]carbonyl-4-[(2-oxidanyl-4-phenyl-butanoyl)amino]-N-quinolin-3-yl-pyrrolidine-2-carboxamide Openeye Name: 1-[4-[(2-aminoacetyl)amino]pyrrolidine-2-carbonyl]-4-[(2-hydroxy-4-phenyl-butanoyl)amino]-N-(3-quinolyl)pyrrolidine-2-carboxamide CAS Name: 1-[[4-[(2-amino-1-oxoethyl)amino]-2-pyrrolidinyl]-oxomethyl]-4-[(2-hydroxy-1-oxo-4-phenylbutyl)amino]-N-(3-quinolinyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-[4-[(2-aminoacetyl)amino]pyrrolidine-2-carbonyl]-4-[(2-hydroxy-4-phenylbutanoyl)amino]-N-quinolin-3-ylpyrrolidine-2-carboxamide Traditional Name: 1-[4-(glycylamino)prolyl]-4-[(2-hydroxy-4-phenyl-butanoyl)amino]-N-(3-quinolyl)pyrrolidine-2-carboxamide Formula: C31H37N7O5 MolecularWeight: 587.66938

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C(=O)N2CC(CC2C(=O)NC3=CC4=CC=CC=C4N=C3)NC(=O)C(CCC5=CC=CC=C5)O)NC(=O)CN

Isomeric SMILES

C1C(CNC1C(=O)N2CC(CC2C(=O)NC3=CC4=CC=CC=C4N=C3)NC(=O)C(CCC5=CC=CC=C5)O)NC(=O)CN

InChI

InChI=1S/C31H37N7O5/c32-15-28(40)35-22-13-25(34-17-22)31(43)38-18-23(37-30(42)27(39)11-10-19-6-2-1-3-7-19)14-26(38)29(41)36-21-12-20-8-4-5-9-24(20)33-16-21/h1-9,12,16,22-23,25-27,34,39H,10-11,13-15,17-18,32H2,(H,35,40)(H,36,41)(H,37,42)