[4-(phenylmethyl)-1,4-diazepan-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone

Systemtic Name: [4-(phenylmethyl)-1,4-diazepan-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Openeye Name: (4-benzyl-1,4-diazepan-1-yl)-(3-phenyl-1H-pyrazol-5-yl)methanone CAS Name: [4-(phenylmethyl)-1,4-diazepan-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone IUPAC Name: (4-benzyl-1,4-diazepan-1-yl)-(3-phenyl-1H-pyrazol-5-yl)methanone Traditional Name: (4-benzyl-1,4-diazepan-1-yl)-(3-phenyl-1H-pyrazol-5-yl)methanone Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC(=NN2)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC(=NN2)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O/c27-22(21-16-20(23-24-21)19-10-5-2-6-11-19)26-13-7-12-25(14-15-26)17-18-8-3-1-4-9-18/h1-6,8-11,16H,7,12-15,17H2,(H,23,24)