4-(2-azanylethanoylamino)-N-[1-[(6,7-dimethylquinolin-3-yl)amino]-1-oxidanylidene-4-phenyl-butan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 4-(2-azanylethanoylamino)-N-[1-[(6,7-dimethylquinolin-3-yl)amino]-1-oxidanylidene-4-phenyl-butan-2-yl]pyrrolidine-2-carboxamide Openeye Name: 4-[(2-aminoacetyl)amino]-N-[1-[(6,7-dimethyl-3-quinolyl)carbamoyl]-3-phenyl-propyl]pyrrolidine-2-carboxamide CAS Name: 4-[(2-amino-1-oxoethyl)amino]-N-[1-[(6,7-dimethyl-3-quinolinyl)amino]-1-oxo-4-phenylbutan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 4-[(2-aminoacetyl)amino]-N-[1-[(6,7-dimethylquinolin-3-yl)amino]-1-oxo-4-phenylbutan-2-yl]pyrrolidine-2-carboxamide Traditional Name: N-[1-[(6,7-dimethyl-3-quinolyl)carbamoyl]-3-phenyl-propyl]-4-(glycylamino)pyrrolidine-2-carboxamide Formula: C28H34N6O3 MolecularWeight: 502.60796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C=N2)NC(=O)C(CCC3=CC=CC=C3)NC(=O)C4CC(CN4)NC(=O)CN)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C=N2)NC(=O)C(CCC3=CC=CC=C3)NC(=O)C4CC(CN4)NC(=O)CN)C

InChI

InChI=1S/C28H34N6O3/c1-17-10-20-12-21(15-30-24(20)11-18(17)2)33-27(36)23(9-8-19-6-4-3-5-7-19)34-28(37)25-13-22(16-31-25)32-26(35)14-29/h3-7,10-12,15,22-23,25,31H,8-9,13-14,16,29H2,1-2H3,(H,32,35)(H,33,36)(H,34,37)