6-methylsulfonyl-1-(oxan-2-yl)-N-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 6-methylsulfonyl-1-(oxan-2-yl)-N-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 6-methylsulfonyl-N-phenethyl-1-tetrahydropyran-2-yl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 6-methylsulfonyl-1-(2-oxanyl)-N-phenethyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 6-methylsulfonyl-1-(oxan-2-yl)-N-phenethylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (6-mesyl-1-tetrahydropyran-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl)-phenethyl-amine Formula: C19H23N5O3S MolecularWeight: 401.48262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC2=C(C=NN2C3CCCCO3)C(=N1)NCCC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=NC2=C(C=NN2C3CCCCO3)C(=N1)NCCC4=CC=CC=C4

InChI

InChI=1S/C19H23N5O3S/c1-28(25,26)19-22-17(20-11-10-14-7-3-2-4-8-14)15-13-21-24(18(15)23-19)16-9-5-6-12-27-16/h2-4,7-8,13,16H,5-6,9-12H2,1H3,(H,20,22,23)