1-methyl-4-methylsulfanyl-3-(5-nitrofuran-2-yl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-methyl-4-methylsulfanyl-3-(5-nitrofuran-2-yl)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-methyl-4-methylsulfanyl-3-(5-nitro-2-furyl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-methyl-4-(methylthio)-3-(5-nitro-2-furanyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-methyl-4-methylsulfanyl-3-(5-nitrofuran-2-yl)pyrazolo[3,4-d]pyrimidine Traditional Name: 1-methyl-4-(methylthio)-3-(5-nitro-2-furyl)pyrazolo[3,4-d]pyrimidine Formula: C11H9N5O3S MolecularWeight: 291.28586

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=N1)C3=CC=C(O3)[N+](=O)[O-])C(=NC=N2)SC

Isomeric SMILES

CN1C2=C(C(=N1)C3=CC=C(O3)[N+](=O)[O-])C(=NC=N2)SC

InChI

InChI=1S/C11H9N5O3S/c1-15-10-8(11(20-2)13-5-12-10)9(14-15)6-3-4-7(19-6)16(17)18/h3-5H,1-2H3