1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 2-(4-benzyl-1,4-diazepan-1-yl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone CAS Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 2-(4-benzyl-1,4-diazepan-1-yl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 2-(4-benzyl-1,4-diazepan-1-yl)-1-(3-phenyl-2-pyrazolin-1-yl)ethanone Formula: C23H28N4O MolecularWeight: 376.49462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(=O)N2CCC(=N2)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)CC(=O)N2CCC(=N2)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O/c28-23(27-15-12-22(24-27)21-10-5-2-6-11-21)19-26-14-7-13-25(16-17-26)18-20-8-3-1-4-9-20/h1-6,8-11H,7,12-19H2