N-(3H-benzimidazol-5-yl)-4-methyl-N-(4-methylphenyl)sulfonyl-benzenesulfonamide

Systemtic Name: N-(3H-benzimidazol-5-yl)-4-methyl-N-(4-methylphenyl)sulfonyl-benzenesulfonamide Openeye Name: N-(3H-benzimidazol-5-yl)-4-methyl-N-(p-tolylsulfonyl)benzenesulfonamide CAS Name: N-(3H-benzimidazol-5-yl)-4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide IUPAC Name: N-(3H-benzimidazol-5-yl)-4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide Traditional Name: N-(3H-benzimidazol-5-yl)-4-methyl-N-tosyl-benzenesulfonamide Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)N=CN3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)N=CN3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C21H19N3O4S2/c1-15-3-8-18(9-4-15)29(25,26)24(17-7-12-20-21(13-17)23-14-22-20)30(27,28)19-10-5-16(2)6-11-19/h3-14H,1-2H3,(H,22,23)