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

Systemtic Name: N-(5-methylhexan-2-yl)-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(1,4-dimethylpentyl)-2-phenyl-triazole-4-carboxamide CAS Name: N-(5-methylhexan-2-yl)-2-phenyl-4-triazolecarboxamide IUPAC Name: N-(5-methylhexan-2-yl)-2-phenyltriazole-4-carboxamide Traditional Name: N-(1,4-dimethylpentyl)-2-phenyl-triazole-4-carboxamide Formula: C16H22N4O MolecularWeight: 286.37208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1=NN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCC(C)NC(=O)C1=NN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H22N4O/c1-12(2)9-10-13(3)18-16(21)15-11-17-20(19-15)14-7-5-4-6-8-14/h4-8,11-13H,9-10H2,1-3H3,(H,18,21)