5-(2-ethylsulfonyl-5-methyl-phenyl)-4-iodanyl-1H-pyrazol-3-amine

Systemtic Name: 5-(2-ethylsulfonyl-5-methyl-phenyl)-4-iodanyl-1H-pyrazol-3-amine Openeye Name: 5-(2-ethylsulfonyl-5-methyl-phenyl)-4-iodo-1H-pyrazol-3-amine CAS Name: 5-(2-ethylsulfonyl-5-methylphenyl)-4-iodo-1H-pyrazol-3-amine IUPAC Name: 5-(2-ethylsulfonyl-5-methylphenyl)-4-iodo-1H-pyrazol-3-amine Traditional Name: [5-(2-esyl-5-methyl-phenyl)-4-iodo-1H-pyrazol-3-yl]amine Formula: C12H14IN3O2S MolecularWeight: 391.22793

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C=C(C=C1)C)C2=C(C(=NN2)N)I

Isomeric SMILES

CCS(=O)(=O)C1=C(C=C(C=C1)C)C2=C(C(=NN2)N)I

InChI

InChI=1S/C12H14IN3O2S/c1-3-19(17,18)9-5-4-7(2)6-8(9)11-10(13)12(14)16-15-11/h4-6H,3H2,1-2H3,(H3,14,15,16)