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

Systemtic Name: N-tert-butyl-1-(2-chloranyl-2-phenyl-ethyl)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-tert-butyl-1-(2-chloro-2-phenyl-ethyl)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-tert-butyl-1-(2-chloro-2-phenylethyl)-6-(methylthio)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-tert-butyl-1-(2-chloro-2-phenylethyl)-6-methylsulfanylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: tert-butyl-[1-(2-chloro-2-phenyl-ethyl)-6-(methylthio)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C18H22ClN5S MolecularWeight: 375.91878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC2=C1C=NN2CC(C3=CC=CC=C3)Cl)SC

Isomeric SMILES

CC(C)(C)NC1=NC(=NC2=C1C=NN2CC(C3=CC=CC=C3)Cl)SC

InChI

InChI=1S/C18H22ClN5S/c1-18(2,3)23-15-13-10-20-24(16(13)22-17(21-15)25-4)11-14(19)12-8-6-5-7-9-12/h5-10,14H,11H2,1-4H3,(H,21,22,23)