3-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: 3-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: 3-methylsulfanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: 3-(methylthio)-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 3-methylsulfanyl-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [4-amino-3-(methylthio)-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C12H12N6S MolecularWeight: 272.32888

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C2=C1C(=NC(=N2)N)N)C3=CC=CC=C3

Isomeric SMILES

CSC1=NN(C2=C1C(=NC(=N2)N)N)C3=CC=CC=C3

InChI

InChI=1S/C12H12N6S/c1-19-11-8-9(13)15-12(14)16-10(8)18(17-11)7-5-3-2-4-6-7/h2-6H,1H3,(H4,13,14,15,16)