4-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 4-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-[(1,5-dimethylpyrazol-4-yl)methyl]-1-isobutyl-1,4-diazepan-2-one CAS Name: 4-[(1,5-dimethyl-4-pyrazolyl)methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 4-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-4-[(1,5-dimethylpyrazol-4-yl)methyl]-1-isobutyl-1,4-diazepan-2-one Formula: C22H32N4O2 MolecularWeight: 384.51508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CN2CC(CN(C(=O)C2)CC(C)C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=NN1C)CN2CC(CN(C(=O)C2)CC(C)C)OCC3=CC=CC=C3

InChI

InChI=1S/C22H32N4O2/c1-17(2)11-26-14-21(28-16-19-8-6-5-7-9-19)13-25(15-22(26)27)12-20-10-23-24(4)18(20)3/h5-10,17,21H,11-16H2,1-4H3