4-[(1-cyclohexyl-1,2,3-triazol-4-yl)carbonyl]-1-[(3,5-dimethylphenyl)methyl]piperazin-2-one

Systemtic Name: 4-[(1-cyclohexyl-1,2,3-triazol-4-yl)carbonyl]-1-[(3,5-dimethylphenyl)methyl]piperazin-2-one Openeye Name: 4-(1-cyclohexyltriazole-4-carbonyl)-1-[(3,5-dimethylphenyl)methyl]piperazin-2-one CAS Name: 4-[(1-cyclohexyl-4-triazolyl)-oxomethyl]-1-[(3,5-dimethylphenyl)methyl]-2-piperazinone IUPAC Name: 4-(1-cyclohexyltriazole-4-carbonyl)-1-[(3,5-dimethylphenyl)methyl]piperazin-2-one Traditional Name: 4-(1-cyclohexyltriazole-4-carbonyl)-1-(3,5-dimethylbenzyl)piperazin-2-one Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2CCN(CC2=O)C(=O)C3=CN(N=N3)C4CCCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2CCN(CC2=O)C(=O)C3=CN(N=N3)C4CCCCC4)C

InChI

InChI=1S/C22H29N5O2/c1-16-10-17(2)12-18(11-16)13-25-8-9-26(15-21(25)28)22(29)20-14-27(24-23-20)19-6-4-3-5-7-19/h10-12,14,19H,3-9,13,15H2,1-2H3