3-(4-fluorophenyl)-N-(2-oxidanylideneazepan-3-yl)-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-N-(2-oxidanylideneazepan-3-yl)-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-(2-oxoazepan-3-yl)-1H-pyrazole-5-carboxamide CAS Name: 3-(4-fluorophenyl)-N-(2-oxo-3-azepanyl)-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-fluorophenyl)-N-(2-oxoazepan-3-yl)-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-(2-ketoazepan-3-yl)-1H-pyrazole-5-carboxamide Formula: C16H17FN4O2 MolecularWeight: 316.330183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H17FN4O2/c17-11-6-4-10(5-7-11)13-9-14(21-20-13)16(23)19-12-3-1-2-8-18-15(12)22/h4-7,9,12H,1-3,8H2,(H,18,22)(H,19,23)(H,20,21)