1-butyl-N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-butyl-N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-butyl-N-[4-(1-methylimidazole-2-carbonyl)phenyl]-6-oxo-pyridazine-3-carboxamide CAS Name: 1-butyl-N-[4-[(1-methyl-2-imidazolyl)-oxomethyl]phenyl]-6-oxo-3-pyridazinecarboxamide IUPAC Name: 1-butyl-N-[4-(1-methylimidazole-2-carbonyl)phenyl]-6-oxopyridazine-3-carboxamide Traditional Name: 1-butyl-6-keto-N-[4-(1-methylimidazole-2-carbonyl)phenyl]pyridazine-3-carboxamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)C(=O)C3=NC=CN3C

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)C(=O)C3=NC=CN3C

InChI

InChI=1S/C20H21N5O3/c1-3-4-12-25-17(26)10-9-16(23-25)20(28)22-15-7-5-14(6-8-15)18(27)19-21-11-13-24(19)2/h5-11,13H,3-4,12H2,1-2H3,(H,22,28)