2-(phenylsulfonylsulfanyl)-1,3-benzothiazole

Systemtic Name: 2-(phenylsulfonylsulfanyl)-1,3-benzothiazole Openeye Name: 2-(benzenesulfonylsulfanyl)-1,3-benzothiazole CAS Name: 2-(benzenesulfonylthio)-1,3-benzothiazole IUPAC Name: 2-(benzenesulfonylsulfanyl)-1,3-benzothiazole Traditional Name: 2-(besylthio)-1,3-benzothiazole Formula: C13H9NO2S3 MolecularWeight: 307.41106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H9NO2S3/c15-19(16,10-6-2-1-3-7-10)18-13-14-11-8-4-5-9-12(11)17-13/h1-9H