2-tert-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-tert-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-tert-butyl-pyrrolidine-1-carboxylate CAS Name: 2-tert-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-tert-butylpyrrolidine-1-carboxylate Traditional Name: 3-[[1-benzyl-2-keto-3-(6-morpholino-1H-benzimidazol-2-yl)-3,4-dihydroquinolin-4-yl]amino]-2-tert-butyl-pyrrolidine-1-carboxylate Formula: C36H41N6O4- MolecularWeight: 621.74854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C(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

CC(C)(C)C1C(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/c1-36(2,3)32-27(15-16-41(32)35(44)45)37-31-25-11-7-8-12-29(25)42(22-23-9-5-4-6-10-23)34(43)30(31)33-38-26-14-13-24(21-28(26)39-33)40-17-19-46-20-18-40/h4-14,21,27,30-32,37H,15-20,22H2,1-3H3,(H,38,39)(H,44,45)/p-1