1-(2-fluorophenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(2-fluorophenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-(2-fluorophenyl)-N-[3-(2-oxoazepan-1-yl)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(2-fluorophenyl)-N-[3-(2-oxo-1-azepanyl)propyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(2-fluorophenyl)-N-[3-(2-oxoazepan-1-yl)propyl]-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(2-fluorophenyl)-N-[3-(2-ketoazepan-1-yl)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C23H26FN5O2 MolecularWeight: 423.483243

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4

InChI

InChI=1S/C23H26FN5O2/c24-19-9-3-4-10-20(19)29-23(28-14-6-7-15-28)18(17-26-29)22(31)25-12-8-16-27-13-5-1-2-11-21(27)30/h3-4,6-7,9-10,14-15,17H,1-2,5,8,11-13,16H2,(H,25,31)