4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-pyrrol-1-ylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-pyrrol-1-ylphenyl)piperazine-1-carboxamide Openeye Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-pyrrol-1-ylphenyl)piperazine-1-carboxamide CAS Name: 4-(6,7-dimethoxy-4-quinazolinyl)-N-[4-(1-pyrrolyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-pyrrol-1-ylphenyl)piperazine-1-carboxamide Traditional Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-pyrrol-1-ylphenyl)piperazine-1-carboxamide Formula: C25H26N6O3 MolecularWeight: 458.51234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)N5C=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)N5C=CC=C5)OC

InChI

InChI=1S/C25H26N6O3/c1-33-22-15-20-21(16-23(22)34-2)26-17-27-24(20)30-11-13-31(14-12-30)25(32)28-18-5-7-19(8-6-18)29-9-3-4-10-29/h3-10,15-17H,11-14H2,1-2H3,(H,28,32)