6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]pyridazine-3-carboxamide

Systemtic Name: 6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]pyridazine-3-carboxamide Openeye Name: 6-methyl-1-(2-nitrophenyl)-4-oxo-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]pyridazine-3-carboxamide CAS Name: 6-methyl-1-(2-nitrophenyl)-4-oxo-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]-3-pyridazinecarboxamide IUPAC Name: 6-methyl-1-(2-nitrophenyl)-4-oxo-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]pyridazine-3-carboxamide Traditional Name: 4-keto-6-methyl-1-(2-nitrophenyl)-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]pyridazine-3-carboxamide Formula: C21H17N7O4 MolecularWeight: 431.40418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NCC3=CC(=NC=C3)N4C=CC=N4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NCC3=CC(=NC=C3)N4C=CC=N4

InChI

InChI=1S/C21H17N7O4/c1-14-11-18(29)20(25-27(14)16-5-2-3-6-17(16)28(31)32)21(30)23-13-15-7-9-22-19(12-15)26-10-4-8-24-26/h2-12H,13H2,1H3,(H,23,30)