4-(4-fluorophenyl)-2-(phenylmethylsulfanyl)-3-(1,3-thiazol-5-yl)benzenesulfonamide

Systemtic Name: 4-(4-fluorophenyl)-2-(phenylmethylsulfanyl)-3-(1,3-thiazol-5-yl)benzenesulfonamide Openeye Name: 2-benzylsulfanyl-4-(4-fluorophenyl)-3-thiazol-5-yl-benzenesulfonamide CAS Name: 4-(4-fluorophenyl)-2-(phenylmethylthio)-3-(5-thiazolyl)benzenesulfonamide IUPAC Name: 2-benzylsulfanyl-4-(4-fluorophenyl)-3-(1,3-thiazol-5-yl)benzenesulfonamide Traditional Name: 2-(benzylthio)-4-(4-fluorophenyl)-3-thiazol-5-yl-benzenesulfonamide Formula: C22H17FN2O2S3 MolecularWeight: 456.575983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C=CC(=C2C3=CN=CS3)C4=CC=C(C=C4)F)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C=CC(=C2C3=CN=CS3)C4=CC=C(C=C4)F)S(=O)(=O)N

InChI

InChI=1S/C22H17FN2O2S3/c23-17-8-6-16(7-9-17)18-10-11-20(30(24,26)27)22(21(18)19-12-25-14-29-19)28-13-15-4-2-1-3-5-15/h1-12,14H,13H2,(H2,24,26,27)