1-cyclohexyl-4-[(1-methylpyrazol-4-yl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-[(1-methylpyrazol-4-yl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-cyclohexyl-4-[(1-methylpyrazol-4-yl)methyl]-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[(1-methyl-4-pyrazolyl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-[(1-methylpyrazol-4-yl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-cyclohexyl-4-[(1-methylpyrazol-4-yl)methyl]-1,4-diazepan-2-one Formula: C23H32N4O2 MolecularWeight: 396.52578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)CN2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H32N4O2/c1-25-13-20(12-24-25)14-26-15-22(29-18-19-8-4-2-5-9-19)16-27(23(28)17-26)21-10-6-3-7-11-21/h2,4-5,8-9,12-13,21-22H,3,6-7,10-11,14-18H2,1H3