1-(4-methylsulfonylphenyl)-N-piperidin-3-yl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(4-methylsulfonylphenyl)-N-piperidin-3-yl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(4-methylsulfonylphenyl)-N-(3-piperidyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(4-methylsulfonylphenyl)-N-(3-piperidinyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(4-methylsulfonylphenyl)-N-piperidin-3-ylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(4-mesylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-(3-piperidyl)amine Formula: C17H20N6O2S MolecularWeight: 372.4447

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4CCCNC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4CCCNC4

InChI

InChI=1S/C17H20N6O2S/c1-26(24,25)14-6-4-13(5-7-14)23-17-15(10-21-23)16(19-11-20-17)22-12-3-2-8-18-9-12/h4-7,10-12,18H,2-3,8-9H2,1H3,(H,19,20,22)