4-(6,7-dimethoxyquinazolin-4-yl)-N-(2-phenylcyclopropyl)piperazine-1-carboxamide

Systemtic Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(2-phenylcyclopropyl)piperazine-1-carboxamide Openeye Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(2-phenylcyclopropyl)piperazine-1-carboxamide CAS Name: 4-(6,7-dimethoxy-4-quinazolinyl)-N-(2-phenylcyclopropyl)-1-piperazinecarboxamide IUPAC Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(2-phenylcyclopropyl)piperazine-1-carboxamide Traditional Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(2-phenylcyclopropyl)piperazine-1-carboxamide Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4CC4C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4CC4C5=CC=CC=C5)OC

InChI

InChI=1S/C24H27N5O3/c1-31-21-13-18-19(14-22(21)32-2)25-15-26-23(18)28-8-10-29(11-9-28)24(30)27-20-12-17(20)16-6-4-3-5-7-16/h3-7,13-15,17,20H,8-12H2,1-2H3,(H,27,30)