N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-1-methyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C18H22N6O3S MolecularWeight: 402.47068

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)NC3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)NC3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C18H22N6O3S/c1-23-18-16(11-21-23)17(19-12-20-18)22-13-7-9-24(10-8-13)28(25,26)15-5-3-14(27-2)4-6-15/h3-6,11-13H,7-10H2,1-2H3,(H,19,20,22)