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

Systemtic Name: [5-azanyl-1-(4-methylsulfonylphenyl)pyrazol-3-yl]-(3-iodanylphenyl)methanone Openeye Name: [5-amino-1-(4-methylsulfonylphenyl)pyrazol-3-yl]-(3-iodophenyl)methanone CAS Name: [5-amino-1-(4-methylsulfonylphenyl)-3-pyrazolyl]-(3-iodophenyl)methanone IUPAC Name: [5-amino-1-(4-methylsulfonylphenyl)pyrazol-3-yl]-(3-iodophenyl)methanone Traditional Name: [5-amino-1-(4-mesylphenyl)pyrazol-3-yl]-(3-iodophenyl)methanone Formula: C17H14IN3O3S MolecularWeight: 467.28083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14IN3O3S/c1-25(23,24)14-7-5-13(6-8-14)21-16(19)10-15(20-21)17(22)11-3-2-4-12(18)9-11/h2-10H,19H2,1H3