N-(6-chloranylpyridin-3-yl)-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(6-chloranylpyridin-3-yl)-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide Openeye Name: N-(6-chloro-3-pyridyl)-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide CAS Name: N-(6-chloro-3-pyridinyl)-4-(6,7-dimethoxy-4-quinazolinyl)-1-piperazinecarboxamide IUPAC Name: N-(6-chloropyridin-3-yl)-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide Traditional Name: N-(6-chloro-3-pyridyl)-4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide Formula: C20H21ClN6O3 MolecularWeight: 428.87214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CN=C(C=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CN=C(C=C4)Cl)OC

InChI

InChI=1S/C20H21ClN6O3/c1-29-16-9-14-15(10-17(16)30-2)23-12-24-19(14)26-5-7-27(8-6-26)20(28)25-13-3-4-18(21)22-11-13/h3-4,9-12H,5-8H2,1-2H3,(H,25,28)