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

Systemtic Name: 5-methyl-N-(2-oxidanylideneazepan-3-yl)-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-methyl-N-(2-oxoazepan-3-yl)-2-phenyl-triazole-4-carboxamide CAS Name: 5-methyl-N-(2-oxo-3-azepanyl)-2-phenyl-4-triazolecarboxamide IUPAC Name: 5-methyl-N-(2-oxoazepan-3-yl)-2-phenyltriazole-4-carboxamide Traditional Name: N-(2-ketoazepan-3-yl)-5-methyl-2-phenyl-triazole-4-carboxamide Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2CCCCNC2=O)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2CCCCNC2=O)C3=CC=CC=C3

InChI

InChI=1S/C16H19N5O2/c1-11-14(20-21(19-11)12-7-3-2-4-8-12)16(23)18-13-9-5-6-10-17-15(13)22/h2-4,7-8,13H,5-6,9-10H2,1H3,(H,17,22)(H,18,23)