6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-N-(5-piperidin-1-ylisoquinolin-8-yl)pyridazine-3-carboxamide

Systemtic Name: 6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-N-(5-piperidin-1-ylisoquinolin-8-yl)pyridazine-3-carboxamide Openeye Name: 6-methyl-1-(2-nitrophenyl)-4-oxo-N-[5-(1-piperidyl)-8-isoquinolyl]pyridazine-3-carboxamide CAS Name: 6-methyl-1-(2-nitrophenyl)-4-oxo-N-[5-(1-piperidinyl)-8-isoquinolinyl]-3-pyridazinecarboxamide IUPAC Name: 6-methyl-1-(2-nitrophenyl)-4-oxo-N-(5-piperidin-1-ylisoquinolin-8-yl)pyridazine-3-carboxamide Traditional Name: 4-keto-6-methyl-1-(2-nitrophenyl)-N-(5-piperidino-8-isoquinolyl)pyridazine-3-carboxamide Formula: C26H24N6O4 MolecularWeight: 484.50656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCCCC5

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCCCC5

InChI

InChI=1S/C26H24N6O4/c1-17-15-24(33)25(29-31(17)22-7-3-4-8-23(22)32(35)36)26(34)28-20-9-10-21(30-13-5-2-6-14-30)18-11-12-27-16-19(18)20/h3-4,7-12,15-16H,2,5-6,13-14H2,1H3,(H,28,34)