4-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-N-phenyl-benzamide

Systemtic Name: 4-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-N-phenyl-benzamide Openeye Name: 4-[(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)methyl]-N-phenyl-benzamide CAS Name: 4-[(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)methyl]-N-phenylbenzamide IUPAC Name: 4-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl]-N-phenylbenzamide Traditional Name: 4-[(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)methyl]-N-phenyl-benzamide Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H18N4O2/c1-14-15(2)24-25(21(27)19(14)12-22)13-16-8-10-17(11-9-16)20(26)23-18-6-4-3-5-7-18/h3-11H,13H2,1-2H3,(H,23,26)