N-hexyl-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-hexyl-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-hexyl-5-methyl-2-phenyl-triazole-4-carboxamide CAS Name: N-hexyl-5-methyl-2-phenyl-4-triazolecarboxamide IUPAC Name: N-hexyl-5-methyl-2-phenyltriazole-4-carboxamide Traditional Name: N-hexyl-5-methyl-2-phenyl-triazole-4-carboxamide Formula: C16H22N4O MolecularWeight: 286.37208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=NN(N=C1C)C2=CC=CC=C2

Isomeric SMILES

CCCCCCNC(=O)C1=NN(N=C1C)C2=CC=CC=C2

InChI

InChI=1S/C16H22N4O/c1-3-4-5-9-12-17-16(21)15-13(2)18-20(19-15)14-10-7-6-8-11-14/h6-8,10-11H,3-5,9,12H2,1-2H3,(H,17,21)