1-[6,7-dimethoxy-4-[(phenylmethyl)amino]quinazolin-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-[6,7-dimethoxy-4-[(phenylmethyl)amino]quinazolin-2-yl]piperidine-4-carboxamide Openeye Name: 1-[4-(benzylamino)-6,7-dimethoxy-quinazolin-2-yl]piperidine-4-carboxamide CAS Name: 1-[6,7-dimethoxy-4-[(phenylmethyl)amino]-2-quinazolinyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-(benzylamino)-6,7-dimethoxyquinazolin-2-yl]piperidine-4-carboxamide Traditional Name: 1-[4-(benzylamino)-6,7-dimethoxy-quinazolin-2-yl]isonipecotamide Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)C(=O)N)NCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)C(=O)N)NCC4=CC=CC=C4)OC

InChI

InChI=1S/C23H27N5O3/c1-30-19-12-17-18(13-20(19)31-2)26-23(28-10-8-16(9-11-28)21(24)29)27-22(17)25-14-15-6-4-3-5-7-15/h3-7,12-13,16H,8-11,14H2,1-2H3,(H2,24,29)(H,25,26,27)