3-(1,3-benzothiazol-2-ylsulfanyl)-N-methyl-N-(3-methylphenyl)propane-1-sulfonamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-methyl-N-(3-methylphenyl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-methyl-N-(m-tolyl)propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-methyl-N-(3-methylphenyl)-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-methyl-N-(3-methylphenyl)propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-methyl-N-(m-tolyl)propane-1-sulfonamide Formula: C18H20N2O2S3 MolecularWeight: 392.5586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C)S(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=CC=C1)N(C)S(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H20N2O2S3/c1-14-7-5-8-15(13-14)20(2)25(21,22)12-6-11-23-18-19-16-9-3-4-10-17(16)24-18/h3-5,7-10,13H,6,11-12H2,1-2H3