N-[2-[4-(azepan-1-ylcarbonyl)phenyl]-4-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]ethanamide

Systemtic Name: N-[2-[4-(azepan-1-ylcarbonyl)phenyl]-4-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]ethanamide Openeye Name: N-[2-[4-(azepane-1-carbonyl)phenyl]-4-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]acetamide CAS Name: N-[2-[4-[1-azepanyl(oxo)methyl]phenyl]-4-(4-fluorophenyl)-5-methyl-3-pyrazolyl]acetamide IUPAC Name: N-[2-[4-(azepane-1-carbonyl)phenyl]-4-(4-fluorophenyl)-5-methylpyrazol-3-yl]acetamide Traditional Name: N-[2-[4-(azepane-1-carbonyl)phenyl]-4-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]acetamide Formula: C25H27FN4O2 MolecularWeight: 434.505883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC=C(C=C2)F)NC(=O)C)C3=CC=C(C=C3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=NN(C(=C1C2=CC=C(C=C2)F)NC(=O)C)C3=CC=C(C=C3)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H27FN4O2/c1-17-23(19-7-11-21(26)12-8-19)24(27-18(2)31)30(28-17)22-13-9-20(10-14-22)25(32)29-15-5-3-4-6-16-29/h7-14H,3-6,15-16H2,1-2H3,(H,27,31)