4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-1-isobutyl-1,4-diazepan-2-one CAS Name: 4-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-(2-methylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-1-isobutyl-1,4-diazepan-2-one Formula: C23H34N4O2 MolecularWeight: 398.54166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN2CC(CN(C(=O)C2)CC(C)C)OCC3=CC=CC=C3

Isomeric SMILES

CCN1C=C(C(=N1)C)CN2CC(CN(C(=O)C2)CC(C)C)OCC3=CC=CC=C3

InChI

InChI=1S/C23H34N4O2/c1-5-27-13-21(19(4)24-27)12-25-14-22(29-17-20-9-7-6-8-10-20)15-26(11-18(2)3)23(28)16-25/h6-10,13,18,22H,5,11-12,14-17H2,1-4H3