N-[4-(cyanomethyl)phenyl]-2-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(4-iodo-3,5-dimethyl-pyrazol-1-yl)acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-(4-iodo-3,5-dimethyl-1-pyrazolyl)acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(4-iodo-3,5-dimethylpyrazol-1-yl)acetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-(4-iodo-3,5-dimethyl-pyrazol-1-yl)acetamide Formula: C15H15IN4O MolecularWeight: 394.21027

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)CC#N)C)I

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)CC#N)C)I

InChI

InChI=1S/C15H15IN4O/c1-10-15(16)11(2)20(19-10)9-14(21)18-13-5-3-12(4-6-13)7-8-17/h3-6H,7,9H2,1-2H3,(H,18,21)