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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SCC2=NN(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

COC1=CC(=CC=C1)SCC2=NN(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)S(=O)(=O)N

InChI

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