N-(5-chloranylpyridin-2-yl)-2,5-dimethyl-3-(4-methylphenyl)sulfonyl-benzenesulfonamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2,5-dimethyl-3-(4-methylphenyl)sulfonyl-benzenesulfonamide Openeye Name: N-(5-chloro-2-pyridyl)-2,5-dimethyl-3-(p-tolylsulfonyl)benzenesulfonamide CAS Name: N-(5-chloro-2-pyridinyl)-2,5-dimethyl-3-(4-methylphenyl)sulfonylbenzenesulfonamide IUPAC Name: N-(5-chloropyridin-2-yl)-2,5-dimethyl-3-(4-methylphenyl)sulfonylbenzenesulfonamide Traditional Name: N-(5-chloro-2-pyridyl)-2,5-dimethyl-3-tosyl-benzenesulfonamide Formula: C20H19ClN2O4S2 MolecularWeight: 450.95886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=CC(=C2)C)S(=O)(=O)NC3=NC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=CC(=C2)C)S(=O)(=O)NC3=NC=C(C=C3)Cl)C

InChI

InChI=1S/C20H19ClN2O4S2/c1-13-4-7-17(8-5-13)28(24,25)18-10-14(2)11-19(15(18)3)29(26,27)23-20-9-6-16(21)12-22-20/h4-12H,1-3H3,(H,22,23)