N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]isoquinoline-3-carboxamide

Systemtic Name: N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]isoquinoline-3-carboxamide Openeye Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]isoquinoline-3-carboxamide CAS Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-3-isoquinolinecarboxamide IUPAC Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]isoquinoline-3-carboxamide Traditional Name: N-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)phenyl]isoquinoline-3-carboxamide Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=N3

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=N3

InChI

InChI=1S/C21H18N4O2/c1-13-10-19(26)24-25-20(13)14-6-8-17(9-7-14)23-21(27)18-11-15-4-2-3-5-16(15)12-22-18/h2-9,11-13H,10H2,1H3,(H,23,27)(H,24,26)