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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=NN(C(=O)C=C3)CCOC

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=NN(C(=O)C=C3)CCOC

InChI

InChI=1S/C21H28N4O3/c1-17-4-6-18(7-5-17)16-23-10-3-11-24(13-12-23)21(27)19-8-9-20(26)25(22-19)14-15-28-2/h4-9H,3,10-16H2,1-2H3