5,7-dibutyl-2-methylsulfonyl-pyrazolo[3,4-d]pyrimidine-4,6-dione

Systemtic Name: 5,7-dibutyl-2-methylsulfonyl-pyrazolo[3,4-d]pyrimidine-4,6-dione Openeye Name: 5,7-dibutyl-2-methylsulfonyl-pyrazolo[3,4-d]pyrimidine-4,6-dione CAS Name: 5,7-dibutyl-2-methylsulfonylpyrazolo[3,4-d]pyrimidine-4,6-dione IUPAC Name: 5,7-dibutyl-2-methylsulfonylpyrazolo[3,4-d]pyrimidine-4,6-dione Traditional Name: 5,7-dibutyl-2-mesyl-pyrazolo[3,4-d]pyrimidine-4,6-quinone Formula: C14H22N4O4S MolecularWeight: 342.41388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NN(C=C2C(=O)N(C1=O)CCCC)S(=O)(=O)C

Isomeric SMILES

CCCCN1C2=NN(C=C2C(=O)N(C1=O)CCCC)S(=O)(=O)C

InChI

InChI=1S/C14H22N4O4S/c1-4-6-8-16-12-11(10-18(15-12)23(3,21)22)13(19)17(14(16)20)9-7-5-2/h10H,4-9H2,1-3H3