N-[1-tert-butyl-3-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[1-tert-butyl-3-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[1-tert-butyl-3-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]-4-methyl-benzenesulfonamide CAS Name: N-[1-tert-butyl-3-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-4-methylbenzenesulfonamide IUPAC Name: N-[1-tert-butyl-3-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-4-methylbenzenesulfonamide Traditional Name: N-[1-tert-butyl-3-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]-4-methyl-benzenesulfonamide Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C3=C2C(=NC=N3)NS(=O)(=O)C4=CC=C(C=C4)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C3=C2C(=NC=N3)NS(=O)(=O)C4=CC=C(C=C4)C)C(C)(C)C

InChI

InChI=1S/C23H25N5O2S/c1-15-6-10-17(11-7-15)20-19-21(24-14-25-22(19)28(26-20)23(3,4)5)27-31(29,30)18-12-8-16(2)9-13-18/h6-14H,1-5H3,(H,24,25,27)