3-(4-chlorophenyl)-5-[(3-methoxyphenyl)sulfanylmethyl]-N-pyrazol-1-yl-benzenesulfonamide

Systemtic Name: 3-(4-chlorophenyl)-5-[(3-methoxyphenyl)sulfanylmethyl]-N-pyrazol-1-yl-benzenesulfonamide Openeye Name: 3-(4-chlorophenyl)-5-[(3-methoxyphenyl)sulfanylmethyl]-N-pyrazol-1-yl-benzenesulfonamide CAS Name: 3-(4-chlorophenyl)-5-[[(3-methoxyphenyl)thio]methyl]-N-(1-pyrazolyl)benzenesulfonamide IUPAC Name: 3-(4-chlorophenyl)-5-[(3-methoxyphenyl)sulfanylmethyl]-N-pyrazol-1-ylbenzenesulfonamide Traditional Name: 3-(4-chlorophenyl)-5-[[(3-methoxyphenyl)thio]methyl]-N-pyrazol-1-yl-benzenesulfonamide Formula: C23H20ClN3O3S2 MolecularWeight: 486.0062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SCC2=CC(=CC(=C2)C3=CC=C(C=C3)Cl)S(=O)(=O)NN4C=CC=N4

Isomeric SMILES

COC1=CC(=CC=C1)SCC2=CC(=CC(=C2)C3=CC=C(C=C3)Cl)S(=O)(=O)NN4C=CC=N4

InChI

InChI=1S/C23H20ClN3O3S2/c1-30-21-4-2-5-22(15-21)31-16-17-12-19(18-6-8-20(24)9-7-18)14-23(13-17)32(28,29)26-27-11-3-10-25-27/h2-15,26H,16H2,1H3