N-(3,5-dimethylphenyl)-4-[1-(4-methylphenyl)-6-oxidanylidene-pyridazin-3-yl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-[1-(4-methylphenyl)-6-oxidanylidene-pyridazin-3-yl]-1,4-diazepane-1-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-4-[6-oxo-1-(p-tolyl)pyridazin-3-yl]-1,4-diazepane-1-carboxamide CAS Name: N-(3,5-dimethylphenyl)-4-[1-(4-methylphenyl)-6-oxo-3-pyridazinyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(3,5-dimethylphenyl)-4-[1-(4-methylphenyl)-6-oxopyridazin-3-yl]-1,4-diazepane-1-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-4-[6-keto-1-(p-tolyl)pyridazin-3-yl]-1,4-diazepane-1-carboxamide Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCCN(CC3)C(=O)NC4=CC(=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCCN(CC3)C(=O)NC4=CC(=CC(=C4)C)C

InChI

InChI=1S/C25H29N5O2/c1-18-5-7-22(8-6-18)30-24(31)10-9-23(27-30)28-11-4-12-29(14-13-28)25(32)26-21-16-19(2)15-20(3)17-21/h5-10,15-17H,4,11-14H2,1-3H3,(H,26,32)