2,5-dimethyl-N-[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]ethyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Traditional Name: 2,5-dimethyl-N-[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Formula: C21H22N6O2S MolecularWeight: 422.50338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCNC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCNC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C21H22N6O2S/c1-15-8-9-16(2)19(12-15)30(28,29)26-11-10-22-20-18-13-25-27(21(18)24-14-23-20)17-6-4-3-5-7-17/h3-9,12-14,26H,10-11H2,1-2H3,(H,22,23,24)