4-methyl-N-(4-methylphenyl)sulfonyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzenesulfonamide

Systemtic Name: 4-methyl-N-(4-methylphenyl)sulfonyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzenesulfonamide Openeye Name: 4-methyl-N-(p-tolylsulfonyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzenesulfonamide CAS Name: 4-methyl-N-(4-methylphenyl)sulfonyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzenesulfonamide IUPAC Name: 4-methyl-N-(4-methylphenyl)sulfonyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzenesulfonamide Traditional Name: 4-methyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-N-tosyl-benzenesulfonamide Formula: C21H22N2O4S3 MolecularWeight: 462.60538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=NC3=C(S2)CCCC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=NC3=C(S2)CCCC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C21H22N2O4S3/c1-15-7-11-17(12-8-15)29(24,25)23(21-22-19-5-3-4-6-20(19)28-21)30(26,27)18-13-9-16(2)10-14-18/h7-14H,3-6H2,1-2H3