2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-methylphenyl)ethanesulfonamide

Systemtic Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-methylphenyl)ethanesulfonamide Openeye Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(o-tolyl)ethanesulfonamide CAS Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)thio]-N-(2-methylphenyl)ethanesulfonamide IUPAC Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-methylphenyl)ethanesulfonamide Traditional Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)thio]-N-(o-tolyl)ethanesulfonamide Formula: C17H18N2O3S3 MolecularWeight: 394.53142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)CCSC2=NC3=C(S2)C=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)CCSC2=NC3=C(S2)C=C(C=C3)OC

InChI

InChI=1S/C17H18N2O3S3/c1-12-5-3-4-6-14(12)19-25(20,21)10-9-23-17-18-15-8-7-13(22-2)11-16(15)24-17/h3-8,11,19H,9-10H2,1-2H3