N-cyano-4-(6,7-dimethoxyquinazolin-4-yl)-N'-(pyridin-4-ylmethyl)piperazine-1-carboximidamide

Systemtic Name: N-cyano-4-(6,7-dimethoxyquinazolin-4-yl)-N'-(pyridin-4-ylmethyl)piperazine-1-carboximidamide Openeye Name: N-cyano-4-(6,7-dimethoxyquinazolin-4-yl)-N'-(4-pyridylmethyl)piperazine-1-carboxamidine CAS Name: N-cyano-4-(6,7-dimethoxy-4-quinazolinyl)-N'-(pyridin-4-ylmethyl)-1-piperazinecarboximidamide IUPAC Name: N-cyano-4-(6,7-dimethoxyquinazolin-4-yl)-N'-(pyridin-4-ylmethyl)piperazine-1-carboximidamide Traditional Name: N-cyano-4-(6,7-dimethoxyquinazolin-4-yl)-N'-(4-pyridylmethyl)piperazine-1-carboxamidine Formula: C22H24N8O2 MolecularWeight: 432.47836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=NCC4=CC=NC=C4)NC#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=NCC4=CC=NC=C4)NC#N)OC

InChI

InChI=1S/C22H24N8O2/c1-31-19-11-17-18(12-20(19)32-2)27-15-28-21(17)29-7-9-30(10-8-29)22(26-14-23)25-13-16-3-5-24-6-4-16/h3-6,11-12,15H,7-10,13H2,1-2H3,(H,25,26)