4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-[(pyridin-4-ylmethylamino)methyl]phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-[(pyridin-4-ylmethylamino)methyl]phenyl]piperazine-1-carboxamide Openeye Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-[(4-pyridylmethylamino)methyl]phenyl]piperazine-1-carboxamide CAS Name: 4-(6,7-dimethoxy-4-quinazolinyl)-N-[4-[(pyridin-4-ylmethylamino)methyl]phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-[(pyridin-4-ylmethylamino)methyl]phenyl]piperazine-1-carboxamide Traditional Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-[(4-pyridylmethylamino)methyl]phenyl]piperazine-1-carboxamide Formula: C28H31N7O3 MolecularWeight: 513.59084

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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)CNCC5=CC=NC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)CNCC5=CC=NC=C5)OC

InChI

InChI=1S/C28H31N7O3/c1-37-25-15-23-24(16-26(25)38-2)31-19-32-27(23)34-11-13-35(14-12-34)28(36)33-22-5-3-20(4-6-22)17-30-18-21-7-9-29-10-8-21/h3-10,15-16,19,30H,11-14,17-18H2,1-2H3,(H,33,36)