6-methylsulfanyl-N-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 6-methylsulfanyl-N-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-benzyl-6-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 6-(methylthio)-N-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: N-benzyl-6-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: benzyl-[6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C13H13N5S MolecularWeight: 271.34082

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=NN2)C(=N1)NCC3=CC=CC=C3

Isomeric SMILES

CSC1=NC2=C(C=NN2)C(=N1)NCC3=CC=CC=C3

InChI

InChI=1S/C13H13N5S/c1-19-13-16-11(10-8-15-18-12(10)17-13)14-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H2,14,15,16,17,18)