1-(2-chloranyl-2-phenyl-ethyl)-N-cyclohexyl-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(2-chloranyl-2-phenyl-ethyl)-N-cyclohexyl-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(2-chloro-2-phenyl-ethyl)-N-cyclohexyl-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(2-chloro-2-phenylethyl)-N-cyclohexyl-6-(methylthio)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(2-chloro-2-phenylethyl)-N-cyclohexyl-6-methylsulfanylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(2-chloro-2-phenyl-ethyl)-6-(methylthio)pyrazolo[3,4-d]pyrimidin-4-yl]-cyclohexyl-amine Formula: C20H24ClN5S MolecularWeight: 401.95606

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=NN2CC(C3=CC=CC=C3)Cl)C(=N1)NC4CCCCC4

Isomeric SMILES

CSC1=NC2=C(C=NN2CC(C3=CC=CC=C3)Cl)C(=N1)NC4CCCCC4

InChI

InChI=1S/C20H24ClN5S/c1-27-20-24-18(23-15-10-6-3-7-11-15)16-12-22-26(19(16)25-20)13-17(21)14-8-4-2-5-9-14/h2,4-5,8-9,12,15,17H,3,6-7,10-11,13H2,1H3,(H,23,24,25)