2-(4-methylphenyl)carbonyl-N-[3-(6-oxidanylidenepyridazin-1-yl)propyl]benzamide

Systemtic Name: 2-(4-methylphenyl)carbonyl-N-[3-(6-oxidanylidenepyridazin-1-yl)propyl]benzamide Openeye Name: 2-(4-methylbenzoyl)-N-[3-(6-oxopyridazin-1-yl)propyl]benzamide CAS Name: 2-[(4-methylphenyl)-oxomethyl]-N-[3-(6-oxo-1-pyridazinyl)propyl]benzamide IUPAC Name: 2-(4-methylbenzoyl)-N-[3-(6-oxopyridazin-1-yl)propyl]benzamide Traditional Name: N-[3-(6-ketopyridazin-1-yl)propyl]-2-p-toluoyl-benzamide Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCCCN3C(=O)C=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCCCN3C(=O)C=CC=N3

InChI

InChI=1S/C22H21N3O3/c1-16-9-11-17(12-10-16)21(27)18-6-2-3-7-19(18)22(28)23-13-5-15-25-20(26)8-4-14-24-25/h2-4,6-12,14H,5,13,15H2,1H3,(H,23,28)