2-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(4-methylphenyl)ethanesulfonamide

Systemtic Name: 2-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(4-methylphenyl)ethanesulfonamide Openeye Name: 2-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(p-tolyl)ethanesulfonamide CAS Name: 2-[(5-methyl-1,3-benzothiazol-2-yl)thio]-N-(4-methylphenyl)ethanesulfonamide IUPAC Name: 2-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(4-methylphenyl)ethanesulfonamide Traditional Name: 2-[(5-methyl-1,3-benzothiazol-2-yl)thio]-N-(p-tolyl)ethanesulfonamide Formula: C17H18N2O2S3 MolecularWeight: 378.53202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)CCSC2=NC3=C(S2)C=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)CCSC2=NC3=C(S2)C=CC(=C3)C

InChI

InChI=1S/C17H18N2O2S3/c1-12-3-6-14(7-4-12)19-24(20,21)10-9-22-17-18-15-11-13(2)5-8-16(15)23-17/h3-8,11,19H,9-10H2,1-2H3