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

Systemtic Name: 4-(2-azanylethanoylamino)-N-[1-[(6-ethylquinolin-3-yl)amino]-1-oxidanylidene-4-phenyl-butan-2-yl]pyrrolidine-2-carboxamide Openeye Name: 4-[(2-aminoacetyl)amino]-N-[1-[(6-ethyl-3-quinolyl)carbamoyl]-3-phenyl-propyl]pyrrolidine-2-carboxamide CAS Name: 4-[(2-amino-1-oxoethyl)amino]-N-[1-[(6-ethyl-3-quinolinyl)amino]-1-oxo-4-phenylbutan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 4-[(2-aminoacetyl)amino]-N-[1-[(6-ethylquinolin-3-yl)amino]-1-oxo-4-phenylbutan-2-yl]pyrrolidine-2-carboxamide Traditional Name: N-[1-[(6-ethyl-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:

CCC1=CC2=CC(=CN=C2C=C1)NC(=O)C(CCC3=CC=CC=C3)NC(=O)C4CC(CN4)NC(=O)CN

Isomeric SMILES

CCC1=CC2=CC(=CN=C2C=C1)NC(=O)C(CCC3=CC=CC=C3)NC(=O)C4CC(CN4)NC(=O)CN

InChI

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