N-(2,6-dimethylphenyl)-4-iodanyl-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-iodanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: N-(2,6-dimethylphenyl)-4-iodo-1-methyl-pyrazole-3-carboxamide CAS Name: N-(2,6-dimethylphenyl)-4-iodo-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-(2,6-dimethylphenyl)-4-iodo-1-methylpyrazole-3-carboxamide Traditional Name: N-(2,6-dimethylphenyl)-4-iodo-1-methyl-pyrazole-3-carboxamide Formula: C13H14IN3O MolecularWeight: 355.17423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=NN(C=C2I)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=NN(C=C2I)C

InChI

InChI=1S/C13H14IN3O/c1-8-5-4-6-9(2)11(8)15-13(18)12-10(14)7-17(3)16-12/h4-7H,1-3H3,(H,15,18)