[5-azanyl-1-(4-methylphenyl)pyrazol-4-yl]-(3-iodanylphenyl)methanone

Systemtic Name: [5-azanyl-1-(4-methylphenyl)pyrazol-4-yl]-(3-iodanylphenyl)methanone Openeye Name: [5-amino-1-(p-tolyl)pyrazol-4-yl]-(3-iodophenyl)methanone CAS Name: [5-amino-1-(4-methylphenyl)-4-pyrazolyl]-(3-iodophenyl)methanone IUPAC Name: [5-amino-1-(4-methylphenyl)pyrazol-4-yl]-(3-iodophenyl)methanone Traditional Name: [5-amino-1-(p-tolyl)pyrazol-4-yl]-(3-iodophenyl)methanone Formula: C17H14IN3O MolecularWeight: 403.21703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14IN3O/c1-11-5-7-14(8-6-11)21-17(19)15(10-20-21)16(22)12-3-2-4-13(18)9-12/h2-10H,19H2,1H3