N-[4-(cyanomethyl)phenyl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-methyl-pyrazole-3-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-methylpyrazole-3-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-methyl-pyrazole-3-carboxamide Formula: C13H12N4O MolecularWeight: 240.26058

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)NC2=CC=C(C=C2)CC#N

Isomeric SMILES

CN1C(=CC=N1)C(=O)NC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C13H12N4O/c1-17-12(7-9-15-17)13(18)16-11-4-2-10(3-5-11)6-8-14/h2-5,7,9H,6H2,1H3,(H,16,18)