[5-azanyl-1-(2,4-dimethylphenyl)pyrazol-4-yl]-(3-iodanylphenyl)methanone

Systemtic Name: [5-azanyl-1-(2,4-dimethylphenyl)pyrazol-4-yl]-(3-iodanylphenyl)methanone Openeye Name: [5-amino-1-(2,4-dimethylphenyl)pyrazol-4-yl]-(3-iodophenyl)methanone CAS Name: [5-amino-1-(2,4-dimethylphenyl)-4-pyrazolyl]-(3-iodophenyl)methanone IUPAC Name: [5-amino-1-(2,4-dimethylphenyl)pyrazol-4-yl]-(3-iodophenyl)methanone Traditional Name: [5-amino-1-(2,4-dimethylphenyl)pyrazol-4-yl]-(3-iodophenyl)methanone Formula: C18H16IN3O MolecularWeight: 417.24361

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C18H16IN3O/c1-11-6-7-16(12(2)8-11)22-18(20)15(10-21-22)17(23)13-4-3-5-14(19)9-13/h3-10H,20H2,1-2H3