1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-N-(2-oxidanyl-1-phenyl-ethyl)-4-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-N-(2-oxidanyl-1-phenyl-ethyl)-4-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-benzyl-N-(2-hydroxy-1-phenyl-ethyl)piperidine-4-carboxamide CAS Name: 1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-N-(2-hydroxy-1-phenylethyl)-4-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-amino-6,7-dimethoxyquinazolin-2-yl)-4-benzyl-N-(2-hydroxy-1-phenylethyl)piperidine-4-carboxamide Traditional Name: 1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-benzyl-N-(2-hydroxy-1-phenyl-ethyl)isonipecotamide Formula: C31H35N5O4 MolecularWeight: 541.6407

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)(CC4=CC=CC=C4)C(=O)NC(CO)C5=CC=CC=C5)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)(CC4=CC=CC=C4)C(=O)NC(CO)C5=CC=CC=C5)N)OC

InChI

InChI=1S/C31H35N5O4/c1-39-26-17-23-24(18-27(26)40-2)34-30(35-28(23)32)36-15-13-31(14-16-36,19-21-9-5-3-6-10-21)29(38)33-25(20-37)22-11-7-4-8-12-22/h3-12,17-18,25,37H,13-16,19-20H2,1-2H3,(H,33,38)(H2,32,34,35)