2-(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)-1-isoquinolin-5-yl-cyclopentane-1-carboximidamide

Systemtic Name: 2-(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)-1-isoquinolin-5-yl-cyclopentane-1-carboximidamide Openeye Name: 2-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-1-(5-isoquinolyl)cyclopentanecarboxamidine CAS Name: 2-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-1-(5-isoquinolinyl)-1-cyclopentanecarboximidamide IUPAC Name: 2-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-1-isoquinolin-5-ylcyclopentane-1-carboximidamide Traditional Name: 1-(5-isoquinolyl)-2-(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)cyclopentanecarboxamidine Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)C3CCCC3(C4=CC=CC5=C4C=CN=C5)C(=N)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)C3CCCC3(C4=CC=CC5=C4C=CN=C5)C(=N)N)OC

InChI

InChI=1S/C25H25N5O3/c1-32-20-11-16-19(12-21(20)33-2)29-22(30-23(16)31)18-7-4-9-25(18,24(26)27)17-6-3-5-14-13-28-10-8-15(14)17/h3,5-6,8,10-13,18H,4,7,9H2,1-2H3,(H3,26,27)(H,29,30,31)