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

Systemtic Name: 1-methyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-methyl-N-[1-(p-tolylsulfonyl)-4-piperidyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-methyl-N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-methyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (1-methylpyrazolo[3,4-d]pyrimidin-4-yl)-(1-tosyl-4-piperidyl)amine Formula: C18H22N6O2S MolecularWeight: 386.47128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC3=NC=NC4=C3C=NN4C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C18H22N6O2S/c1-13-3-5-15(6-4-13)27(25,26)24-9-7-14(8-10-24)22-17-16-11-21-23(2)18(16)20-12-19-17/h3-6,11-12,14H,7-10H2,1-2H3,(H,19,20,22)