N-(5-chloranyl-2,4-dimethoxy-phenyl)-4-[1-(4-methylphenyl)-6-oxidanylidene-pyridazin-3-yl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-4-[1-(4-methylphenyl)-6-oxidanylidene-pyridazin-3-yl]-1,4-diazepane-1-carboxamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-[6-oxo-1-(p-tolyl)pyridazin-3-yl]-1,4-diazepane-1-carboxamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-[1-(4-methylphenyl)-6-oxo-3-pyridazinyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-[1-(4-methylphenyl)-6-oxopyridazin-3-yl]-1,4-diazepane-1-carboxamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-4-[6-keto-1-(p-tolyl)pyridazin-3-yl]-1,4-diazepane-1-carboxamide Formula: C25H28ClN5O4 MolecularWeight: 497.97392

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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(=C(C=C4OC)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCCN(CC3)C(=O)NC4=CC(=C(C=C4OC)OC)Cl

InChI

InChI=1S/C25H28ClN5O4/c1-17-5-7-18(8-6-17)31-24(32)10-9-23(28-31)29-11-4-12-30(14-13-29)25(33)27-20-15-19(26)21(34-2)16-22(20)35-3/h5-10,15-16H,4,11-14H2,1-3H3,(H,27,33)