2-butyl-3-[[3-(6-morpholin-4-yl-1H-benzimidazol-2-yl)-2-oxidanylidene-1-(phenylmethyl)-3,4-dihydroquinolin-4-yl]amino]pyrrolidine-1-carboxylate

Systemtic Name: 2-butyl-3-[[3-(6-morpholin-4-yl-1H-benzimidazol-2-yl)-2-oxidanylidene-1-(phenylmethyl)-3,4-dihydroquinolin-4-yl]amino]pyrrolidine-1-carboxylate Openeye Name: 3-[[1-benzyl-3-(6-morpholino-1H-benzimidazol-2-yl)-2-oxo-3,4-dihydroquinolin-4-yl]amino]-2-butyl-pyrrolidine-1-carboxylate CAS Name: 2-butyl-3-[[3-[6-(4-morpholinyl)-1H-benzimidazol-2-yl]-2-oxo-1-(phenylmethyl)-3,4-dihydroquinolin-4-yl]amino]-1-pyrrolidinecarboxylate IUPAC Name: 3-[[1-benzyl-3-(6-morpholin-4-yl-1H-benzimidazol-2-yl)-2-oxo-3,4-dihydroquinolin-4-yl]amino]-2-butylpyrrolidine-1-carboxylate Traditional Name: 3-[[1-benzyl-2-keto-3-(6-morpholino-1H-benzimidazol-2-yl)-3,4-dihydroquinolin-4-yl]amino]-2-butyl-pyrrolidine-1-carboxylate Formula: C36H41N6O4- MolecularWeight: 621.74854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(CCN1C(=O)[O-])NC2C(C(=O)N(C3=CC=CC=C23)CC4=CC=CC=C4)C5=NC6=C(N5)C=C(C=C6)N7CCOCC7

Isomeric SMILES

CCCCC1C(CCN1C(=O)[O-])NC2C(C(=O)N(C3=CC=CC=C23)CC4=CC=CC=C4)C5=NC6=C(N5)C=C(C=C6)N7CCOCC7

InChI

InChI=1S/C36H42N6O4/c1-2-3-12-31-28(16-17-41(31)36(44)45)37-33-26-11-7-8-13-30(26)42(23-24-9-5-4-6-10-24)35(43)32(33)34-38-27-15-14-25(22-29(27)39-34)40-18-20-46-21-19-40/h4-11,13-15,22,28,31-33,37H,2-3,12,16-21,23H2,1H3,(H,38,39)(H,44,45)/p-1