3-(azepan-1-yl)-1-methyl-5-[2-(2-methylphenyl)ethyl]pyrazin-2-one

Systemtic Name: 3-(azepan-1-yl)-1-methyl-5-[2-(2-methylphenyl)ethyl]pyrazin-2-one Openeye Name: 3-(azepan-1-yl)-1-methyl-5-[2-(o-tolyl)ethyl]pyrazin-2-one CAS Name: 3-(1-azepanyl)-1-methyl-5-[2-(2-methylphenyl)ethyl]-2-pyrazinone IUPAC Name: 3-(azepan-1-yl)-1-methyl-5-[2-(2-methylphenyl)ethyl]pyrazin-2-one Traditional Name: 3-(azepan-1-yl)-1-methyl-5-[2-(o-tolyl)ethyl]pyrazin-2-one Formula: C20H27N3O MolecularWeight: 325.44788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC2=CN(C(=O)C(=N2)N3CCCCCC3)C

Isomeric SMILES

CC1=CC=CC=C1CCC2=CN(C(=O)C(=N2)N3CCCCCC3)C

InChI

InChI=1S/C20H27N3O/c1-16-9-5-6-10-17(16)11-12-18-15-22(2)20(24)19(21-18)23-13-7-3-4-8-14-23/h5-6,9-10,15H,3-4,7-8,11-14H2,1-2H3