N-[1-(4-cyanobutyl)pyrazol-4-yl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[1-(4-cyanobutyl)pyrazol-4-yl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[1-(4-cyanobutyl)pyrazol-4-yl]-5-methyl-2-phenyl-triazole-4-carboxamide CAS Name: N-[1-(4-cyanobutyl)-4-pyrazolyl]-5-methyl-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[1-(4-cyanobutyl)pyrazol-4-yl]-5-methyl-2-phenyltriazole-4-carboxamide Traditional Name: N-[1-(4-cyanobutyl)pyrazol-4-yl]-5-methyl-2-phenyl-triazole-4-carboxamide Formula: C18H19N7O MolecularWeight: 349.38976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2=CN(N=C2)CCCCC#N)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2=CN(N=C2)CCCCC#N)C3=CC=CC=C3

InChI

InChI=1S/C18H19N7O/c1-14-17(23-25(22-14)16-8-4-2-5-9-16)18(26)21-15-12-20-24(13-15)11-7-3-6-10-19/h2,4-5,8-9,12-13H,3,6-7,11H2,1H3,(H,21,26)