3-(3-fluorophenyl)-N-(1-methylsulfonylpiperidin-4-yl)-2H-pyrazolo[3,4-d]pyrimidin-6-amine

Systemtic Name: 3-(3-fluorophenyl)-N-(1-methylsulfonylpiperidin-4-yl)-2H-pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: 3-(3-fluorophenyl)-N-(1-methylsulfonyl-4-piperidyl)-2H-pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: 3-(3-fluorophenyl)-N-(1-methylsulfonyl-4-piperidinyl)-2H-pyrazolo[3,4-d]pyrimidin-6-amine IUPAC Name: 3-(3-fluorophenyl)-N-(1-methylsulfonylpiperidin-4-yl)-2H-pyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: [3-(3-fluorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]-(1-mesyl-4-piperidyl)amine Formula: C17H19FN6O2S MolecularWeight: 390.435163

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC2=NC3=NNC(=C3C=N2)C4=CC(=CC=C4)F

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC2=NC3=NNC(=C3C=N2)C4=CC(=CC=C4)F

InChI

InChI=1S/C17H19FN6O2S/c1-27(25,26)24-7-5-13(6-8-24)20-17-19-10-14-15(22-23-16(14)21-17)11-3-2-4-12(18)9-11/h2-4,9-10,13H,5-8H2,1H3,(H2,19,20,21,22,23)