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

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-methylphenyl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(m-tolyl)propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(3-methylphenyl)-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-methylphenyl)propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(m-tolyl)propane-1-sulfonamide Formula: C17H18N2O2S3 MolecularWeight: 378.53202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H18N2O2S3/c1-13-6-4-7-14(12-13)19-24(20,21)11-5-10-22-17-18-15-8-2-3-9-16(15)23-17/h2-4,6-9,12,19H,5,10-11H2,1H3