N-[4-cyano-5-(cyanomethyl)-2-phenyl-pyrazol-3-yl]propanamide

Systemtic Name: N-[4-cyano-5-(cyanomethyl)-2-phenyl-pyrazol-3-yl]propanamide Openeye Name: N-[4-cyano-5-(cyanomethyl)-2-phenyl-pyrazol-3-yl]propanamide CAS Name: N-[4-cyano-5-(cyanomethyl)-2-phenyl-3-pyrazolyl]propanamide IUPAC Name: N-[4-cyano-5-(cyanomethyl)-2-phenylpyrazol-3-yl]propanamide Traditional Name: N-[4-cyano-5-(cyanomethyl)-2-phenyl-pyrazol-3-yl]propionamide Formula: C15H13N5O MolecularWeight: 279.29662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=NN1C2=CC=CC=C2)CC#N)C#N

Isomeric SMILES

CCC(=O)NC1=C(C(=NN1C2=CC=CC=C2)CC#N)C#N

InChI

InChI=1S/C15H13N5O/c1-2-14(21)18-15-12(10-17)13(8-9-16)19-20(15)11-6-4-3-5-7-11/h3-7H,2,8H2,1H3,(H,18,21)