4-[(3,5-dimethylphenyl)methylamino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide

Systemtic Name: 4-[(3,5-dimethylphenyl)methylamino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Openeye Name: 4-[(3,5-dimethylphenyl)methylamino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide CAS Name: 4-[(3,5-dimethylphenyl)methylamino]-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(3,5-dimethylphenyl)methylamino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Traditional Name: 4-[(3,5-dimethylbenzyl)amino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CNC2=CC=C(C=C2)S(=O)(=O)NC3=NC(=CC(=N3)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CNC2=CC=C(C=C2)S(=O)(=O)NC3=NC(=CC(=N3)C)C)C

InChI

InChI=1S/C21H24N4O2S/c1-14-9-15(2)11-18(10-14)13-22-19-5-7-20(8-6-19)28(26,27)25-21-23-16(3)12-17(4)24-21/h5-12,22H,13H2,1-4H3,(H,23,24,25)