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

Systemtic Name: 6-(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)-1-isoquinolin-5-yl-4-methoxy-cyclohex-2-ene-1-carboximidamide Openeye Name: 6-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-1-(5-isoquinolyl)-4-methoxy-cyclohex-2-ene-1-carboxamidine CAS Name: 6-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-1-(5-isoquinolinyl)-4-methoxy-1-cyclohex-2-enecarboximidamide IUPAC Name: 6-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-1-isoquinolin-5-yl-4-methoxycyclohex-2-ene-1-carboximidamide Traditional Name: 1-(5-isoquinolyl)-6-(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)-4-methoxy-cyclohex-2-ene-1-carboxamidine Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(C(C=C1)(C2=CC=CC3=C2C=CN=C3)C(=N)N)C4=NC(=O)C5=CC(=C(C=C5N4)OC)OC

Isomeric SMILES

COC1CC(C(C=C1)(C2=CC=CC3=C2C=CN=C3)C(=N)N)C4=NC(=O)C5=CC(=C(C=C5N4)OC)OC

InChI

InChI=1S/C27H27N5O4/c1-34-16-7-9-27(26(28)29,19-6-4-5-15-14-30-10-8-17(15)19)20(11-16)24-31-21-13-23(36-3)22(35-2)12-18(21)25(33)32-24/h4-10,12-14,16,20H,11H2,1-3H3,(H3,28,29)(H,31,32,33)