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

Systemtic Name: 1-[2-chloranyl-2-(4-chlorophenyl)ethyl]-6-methylsulfanyl-N-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-[2-chloro-2-(4-chlorophenyl)ethyl]-6-methylsulfanyl-N-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-[2-chloro-2-(4-chlorophenyl)ethyl]-6-(methylthio)-N-phenethyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-[2-chloro-2-(4-chlorophenyl)ethyl]-6-methylsulfanyl-N-phenethylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-[2-chloro-2-(4-chlorophenyl)ethyl]-6-(methylthio)pyrazolo[3,4-d]pyrimidin-4-yl]-phenethyl-amine Formula: C22H21Cl2N5S MolecularWeight: 458.40664

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=NN2CC(C3=CC=C(C=C3)Cl)Cl)C(=N1)NCCC4=CC=CC=C4

Isomeric SMILES

CSC1=NC2=C(C=NN2CC(C3=CC=C(C=C3)Cl)Cl)C(=N1)NCCC4=CC=CC=C4

InChI

InChI=1S/C22H21Cl2N5S/c1-30-22-27-20(25-12-11-15-5-3-2-4-6-15)18-13-26-29(21(18)28-22)14-19(24)16-7-9-17(23)10-8-16/h2-10,13,19H,11-12,14H2,1H3,(H,25,27,28)