4-(2-methylpropyl)-1-[3-(pyrazol-1-ylmethyl)phenyl]carbonyl-1,4-diazepan-5-one

Systemtic Name: 4-(2-methylpropyl)-1-[3-(pyrazol-1-ylmethyl)phenyl]carbonyl-1,4-diazepan-5-one Openeye Name: 4-isobutyl-1-[3-(pyrazol-1-ylmethyl)benzoyl]-1,4-diazepan-5-one CAS Name: 4-(2-methylpropyl)-1-[oxo-[3-(1-pyrazolylmethyl)phenyl]methyl]-1,4-diazepan-5-one IUPAC Name: 4-(2-methylpropyl)-1-[3-(pyrazol-1-ylmethyl)benzoyl]-1,4-diazepan-5-one Traditional Name: 4-isobutyl-1-[3-(pyrazol-1-ylmethyl)benzoyl]-1,4-diazepan-5-one Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CCC1=O)C(=O)C2=CC(=CC=C2)CN3C=CC=N3

Isomeric SMILES

CC(C)CN1CCN(CCC1=O)C(=O)C2=CC(=CC=C2)CN3C=CC=N3

InChI

InChI=1S/C20H26N4O2/c1-16(2)14-23-12-11-22(10-7-19(23)25)20(26)18-6-3-5-17(13-18)15-24-9-4-8-21-24/h3-6,8-9,13,16H,7,10-12,14-15H2,1-2H3