N-phenyl-2-[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-phenyl-2-[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-phenyl-2-[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-phenyl-2-[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-phenyl-2-[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-phenyl-2-[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]acetamide Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(=O)NC2=CC=CC=C2)CC3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)CC(=O)NC2=CC=CC=C2)CC3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H27N5O/c29-22(25-21-10-5-2-6-11-21)18-28-13-7-12-27(14-15-28)17-20-16-24-26-23(20)19-8-3-1-4-9-19/h1-6,8-11,16H,7,12-15,17-18H2,(H,24,26)(H,25,29)