N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(2-oxidanylideneazepan-1-yl)ethanamide

Systemtic Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(2-oxidanylideneazepan-1-yl)ethanamide Openeye Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(2-oxoazepan-1-yl)acetamide CAS Name: N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-2-(2-oxo-1-azepanyl)acetamide IUPAC Name: N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-2-(2-oxoazepan-1-yl)acetamide Traditional Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(2-ketoazepan-1-yl)acetamide Formula: C24H25FN4O2 MolecularWeight: 420.479303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C24H25FN4O2/c25-20-12-10-18(11-13-20)24-19(16-29(27-24)21-7-3-1-4-8-21)15-26-22(30)17-28-14-6-2-5-9-23(28)31/h1,3-4,7-8,10-13,16H,2,5-6,9,14-15,17H2,(H,26,30)