1,6-dimethyl-N-[2-(phenylmethyl)sulfonylethyl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1,6-dimethyl-N-[2-(phenylmethyl)sulfonylethyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(2-benzylsulfonylethyl)-1,6-dimethyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1,6-dimethyl-N-[2-(phenylmethyl)sulfonylethyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(2-benzylsulfonylethyl)-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 2-benzylsulfonylethyl-(1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C)C(=N1)NCCS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=NC2=C(C=NN2C)C(=N1)NCCS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H19N5O2S/c1-12-19-15(14-10-18-21(2)16(14)20-12)17-8-9-24(22,23)11-13-6-4-3-5-7-13/h3-7,10H,8-9,11H2,1-2H3,(H,17,19,20)