1-(4-fluorophenyl)-5-methyl-N-(2-oxidanylideneazepan-3-yl)-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-5-methyl-N-(2-oxidanylideneazepan-3-yl)-1,2,4-triazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-5-methyl-N-(2-oxoazepan-3-yl)-1,2,4-triazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-5-methyl-N-(2-oxo-3-azepanyl)-1,2,4-triazole-3-carboxamide IUPAC Name: 1-(4-fluorophenyl)-5-methyl-N-(2-oxoazepan-3-yl)-1,2,4-triazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-(2-ketoazepan-3-yl)-5-methyl-1,2,4-triazole-3-carboxamide Formula: C16H18FN5O2 MolecularWeight: 331.344823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NC3CCCCNC3=O

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NC3CCCCNC3=O

InChI

InChI=1S/C16H18FN5O2/c1-10-19-14(21-22(10)12-7-5-11(17)6-8-12)16(24)20-13-4-2-3-9-18-15(13)23/h5-8,13H,2-4,9H2,1H3,(H,18,23)(H,20,24)