4-[(3-fluorophenyl)methylsulfanyl]-1-methyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[(3-fluorophenyl)methylsulfanyl]-1-methyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[(3-fluorophenyl)methylsulfanyl]-1-methyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[(3-fluorophenyl)methylthio]-1-methylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[(3-fluorophenyl)methylsulfanyl]-1-methylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[(3-fluorobenzyl)thio]-1-methyl-pyrazolo[3,4-d]pyrimidine Formula: C13H11FN4S MolecularWeight: 274.316643

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC3=CC(=CC=C3)F

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC3=CC(=CC=C3)F

InChI

InChI=1S/C13H11FN4S/c1-18-12-11(6-17-18)13(16-8-15-12)19-7-9-3-2-4-10(14)5-9/h2-6,8H,7H2,1H3