diethyl 2-[[4-[(2,4-dibenzamidoquinazolin-6-yl)methylamino]phenyl]carbonylamino]-2-methyl-propanedioate

Systemtic Name: diethyl 2-[[4-[(2,4-dibenzamidoquinazolin-6-yl)methylamino]phenyl]carbonylamino]-2-methyl-propanedioate Openeye Name: diethyl 2-[[4-[(2,4-dibenzamidoquinazolin-6-yl)methylamino]benzoyl]amino]-2-methyl-propanedioate CAS Name: 2-[[[4-[(2,4-dibenzamido-6-quinazolinyl)methylamino]phenyl]-oxomethyl]amino]-2-methylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-[(2,4-dibenzamidoquinazolin-6-yl)methylamino]benzoyl]amino]-2-methylpropanedioate Traditional Name: 2-[[4-[(2,4-dibenzamidoquinazolin-6-yl)methylamino]benzoyl]amino]-2-methyl-malonic acid diethyl ester Formula: C38H36N6O7 MolecularWeight: 688.72844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C(=O)OCC)NC(=O)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)N=C(N=C3NC(=O)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C(C)(C(=O)OCC)NC(=O)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)N=C(N=C3NC(=O)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C38H36N6O7/c1-4-50-35(48)38(3,36(49)51-5-2)44-34(47)27-17-19-28(20-18-27)39-23-24-16-21-30-29(22-24)31(41-32(45)25-12-8-6-9-13-25)42-37(40-30)43-33(46)26-14-10-7-11-15-26/h6-22,39H,4-5,23H2,1-3H3,(H,44,47)(H2,40,41,42,43,45,46)