5-(4-chlorophenyl)-3-(1H-imidazol-5-yl)-2-(phenylsulfanylmethyl)benzenesulfonamide

Systemtic Name: 5-(4-chlorophenyl)-3-(1H-imidazol-5-yl)-2-(phenylsulfanylmethyl)benzenesulfonamide Openeye Name: 5-(4-chlorophenyl)-3-(1H-imidazol-5-yl)-2-(phenylsulfanylmethyl)benzenesulfonamide CAS Name: 5-(4-chlorophenyl)-3-(1H-imidazol-5-yl)-2-[(phenylthio)methyl]benzenesulfonamide IUPAC Name: 5-(4-chlorophenyl)-3-(1H-imidazol-5-yl)-2-(phenylsulfanylmethyl)benzenesulfonamide Traditional Name: 5-(4-chlorophenyl)-3-(1H-imidazol-5-yl)-2-[(phenylthio)methyl]benzenesulfonamide Formula: C22H18ClN3O2S2 MolecularWeight: 455.98022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=C(C=C(C=C2S(=O)(=O)N)C3=CC=C(C=C3)Cl)C4=CN=CN4

Isomeric SMILES

C1=CC=C(C=C1)SCC2=C(C=C(C=C2S(=O)(=O)N)C3=CC=C(C=C3)Cl)C4=CN=CN4

InChI

InChI=1S/C22H18ClN3O2S2/c23-17-8-6-15(7-9-17)16-10-19(21-12-25-14-26-21)20(22(11-16)30(24,27)28)13-29-18-4-2-1-3-5-18/h1-12,14H,13H2,(H,25,26)(H2,24,27,28)