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

Systemtic Name: [5-azanyl-1-(3-methoxyphenyl)pyrazol-4-yl]-(3-iodanylphenyl)methanone Openeye Name: [5-amino-1-(3-methoxyphenyl)pyrazol-4-yl]-(3-iodophenyl)methanone CAS Name: [5-amino-1-(3-methoxyphenyl)-4-pyrazolyl]-(3-iodophenyl)methanone IUPAC Name: [5-amino-1-(3-methoxyphenyl)pyrazol-4-yl]-(3-iodophenyl)methanone Traditional Name: [5-amino-1-(3-methoxyphenyl)pyrazol-4-yl]-(3-iodophenyl)methanone Formula: C17H14IN3O2 MolecularWeight: 419.21643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=C(C=N2)C(=O)C3=CC(=CC=C3)I)N

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=C(C=N2)C(=O)C3=CC(=CC=C3)I)N

InChI

InChI=1S/C17H14IN3O2/c1-23-14-7-3-6-13(9-14)21-17(19)15(10-20-21)16(22)11-4-2-5-12(18)8-11/h2-10H,19H2,1H3