2-[[6-ethylsulfanyl-4-(1-phenylethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]methylsulfanyl]ethanol

Systemtic Name: 2-[[6-ethylsulfanyl-4-(1-phenylethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]methylsulfanyl]ethanol Openeye Name: 2-[[6-ethylsulfanyl-4-(1-phenylethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]methylsulfanyl]ethanol CAS Name: 2-[[6-(ethylthio)-4-(1-phenylethylamino)-1-pyrazolo[3,4-d]pyrimidinyl]methylthio]ethanol IUPAC Name: 2-[[6-ethylsulfanyl-4-(1-phenylethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]methylsulfanyl]ethanol Traditional Name: 2-[[6-(ethylthio)-4-(1-phenylethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]methylthio]ethanol Formula: C18H23N5OS2 MolecularWeight: 389.53812

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CSCCO)C(=N1)NC(C)C3=CC=CC=C3

Isomeric SMILES

CCSC1=NC2=C(C=NN2CSCCO)C(=N1)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C18H23N5OS2/c1-3-26-18-21-16(20-13(2)14-7-5-4-6-8-14)15-11-19-23(17(15)22-18)12-25-10-9-24/h4-8,11,13,24H,3,9-10,12H2,1-2H3,(H,20,21,22)