6-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]-2-propyl-pyridazin-3-one

Systemtic Name: 6-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]-2-propyl-pyridazin-3-one Openeye Name: 6-[4-[(4-methoxyphenyl)methyl]-1,4-diazepane-1-carbonyl]-2-propyl-pyridazin-3-one CAS Name: 6-[[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-oxomethyl]-2-propyl-3-pyridazinone IUPAC Name: 6-[4-[(4-methoxyphenyl)methyl]-1,4-diazepane-1-carbonyl]-2-propylpyridazin-3-one Traditional Name: 6-(4-p-anisyl-1,4-diazepane-1-carbonyl)-2-propyl-pyridazin-3-one Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)N2CCCN(CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)N2CCCN(CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H28N4O3/c1-3-11-25-20(26)10-9-19(22-25)21(27)24-13-4-12-23(14-15-24)16-17-5-7-18(28-2)8-6-17/h5-10H,3-4,11-16H2,1-2H3