4-[[(4-iodophenyl)amino]methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one

Systemtic Name: 4-[[(4-iodophenyl)amino]methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Openeye Name: 4-[(4-iodoanilino)methylene]-5-methyl-2-(p-tolyl)pyrazol-3-one CAS Name: 4-[(4-iodoanilino)methylidene]-5-methyl-2-(4-methylphenyl)-3-pyrazolone IUPAC Name: 4-[(4-iodoanilino)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Traditional Name: 4-[(4-iodoanilino)methylene]-5-methyl-2-(p-tolyl)-2-pyrazolin-3-one Formula: C18H16IN3O MolecularWeight: 417.24361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=C(C=C3)I)C(=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=C(C=C3)I)C(=N2)C

InChI

InChI=1S/C18H16IN3O/c1-12-3-9-16(10-4-12)22-18(23)17(13(2)21-22)11-20-15-7-5-14(19)6-8-15/h3-11,20H,1-2H3