2,4-dimethyl-5-[methyl-(4-methylphenyl)sulfonyl-amino]-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: 2,4-dimethyl-5-[methyl-(4-methylphenyl)sulfonyl-amino]-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: 2,4-dimethyl-5-[methyl(p-tolylsulfonyl)amino]-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: 2,4-dimethyl-5-[methyl-(4-methylphenyl)sulfonylamino]-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: 2,4-dimethyl-5-[methyl-(4-methylphenyl)sulfonylamino]-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 2,4-dimethyl-5-[methyl(tosyl)amino]-N-(3-pyridylmethyl)benzenesulfonamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC(=C(C=C2C)C)S(=O)(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC(=C(C=C2C)C)S(=O)(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C22H25N3O4S2/c1-16-7-9-20(10-8-16)31(28,29)25(4)21-13-22(18(3)12-17(21)2)30(26,27)24-15-19-6-5-11-23-14-19/h5-14,24H,15H2,1-4H3