N-isoquinolin-5-yl-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-isoquinolin-5-yl-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-(5-isoquinolyl)-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-(5-isoquinolinyl)-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-isoquinolin-5-yl-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: N-(5-isoquinolyl)-6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)NC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)NC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C22H18N4O3/c27-21-10-9-20(25-26(21)13-14-29-17-6-2-1-3-7-17)22(28)24-19-8-4-5-16-15-23-12-11-18(16)19/h1-12,15H,13-14H2,(H,24,28)