4-methyl-2-(phenylsulfonylsulfanyl)-1,3-benzothiazole

Systemtic Name: 4-methyl-2-(phenylsulfonylsulfanyl)-1,3-benzothiazole Openeye Name: 2-(benzenesulfonylsulfanyl)-4-methyl-1,3-benzothiazole CAS Name: 2-(benzenesulfonylthio)-4-methyl-1,3-benzothiazole IUPAC Name: 2-(benzenesulfonylsulfanyl)-4-methyl-1,3-benzothiazole Traditional Name: 2-(besylthio)-4-methyl-1,3-benzothiazole Formula: C14H11NO2S3 MolecularWeight: 321.43764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)SS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)SS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C14H11NO2S3/c1-10-6-5-9-12-13(10)15-14(18-12)19-20(16,17)11-7-3-2-4-8-11/h2-9H,1H3