N-(2,5-dimethylphenyl)-2-(4-iodanylpyrazol-1-yl)ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-(4-iodanylpyrazol-1-yl)ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-(4-iodopyrazol-1-yl)acetamide CAS Name: N-(2,5-dimethylphenyl)-2-(4-iodo-1-pyrazolyl)acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(4-iodopyrazol-1-yl)acetamide Traditional Name: N-(2,5-dimethylphenyl)-2-(4-iodopyrazol-1-yl)acetamide Formula: C13H14IN3O MolecularWeight: 355.17423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CN2C=C(C=N2)I

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CN2C=C(C=N2)I

InChI

InChI=1S/C13H14IN3O/c1-9-3-4-10(2)12(5-9)16-13(18)8-17-7-11(14)6-15-17/h3-7H,8H2,1-2H3,(H,16,18)