1-cyclohexyl-4-[(5-methyl-1H-pyrazol-3-yl)carbonyl]-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-[(5-methyl-1H-pyrazol-3-yl)carbonyl]-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-cyclohexyl-4-(5-methyl-1H-pyrazole-3-carbonyl)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[(5-methyl-1H-pyrazol-3-yl)-oxomethyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(5-methyl-1H-pyrazole-3-carbonyl)-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-cyclohexyl-4-(5-methyl-1H-pyrazole-3-carbonyl)-1,4-diazepan-2-one Formula: C23H30N4O3 MolecularWeight: 410.5093

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1)C(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H30N4O3/c1-17-12-21(25-24-17)23(29)26-13-20(30-16-18-8-4-2-5-9-18)14-27(22(28)15-26)19-10-6-3-7-11-19/h2,4-5,8-9,12,19-20H,3,6-7,10-11,13-16H2,1H3,(H,24,25)