4-methyl-3-(3-methylbutylsulfanyl)-1-propan-2-yl-pyrazolo[4,3-d]pyrimidine-5,7-dione

Systemtic Name: 4-methyl-3-(3-methylbutylsulfanyl)-1-propan-2-yl-pyrazolo[4,3-d]pyrimidine-5,7-dione Openeye Name: 3-isopentylsulfanyl-1-isopropyl-4-methyl-pyrazolo[4,3-d]pyrimidine-5,7-dione CAS Name: 4-methyl-3-(3-methylbutylthio)-1-propan-2-ylpyrazolo[4,3-d]pyrimidine-5,7-dione IUPAC Name: 4-methyl-3-(3-methylbutylsulfanyl)-1-propan-2-ylpyrazolo[4,3-d]pyrimidine-5,7-dione Traditional Name: 3-(isoamylthio)-1-isopropyl-4-methyl-pyrazolo[4,3-d]pyrimidine-5,7-quinone Formula: C14H22N4O2S MolecularWeight: 310.41508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NN(C2=C1N(C(=O)NC2=O)C)C(C)C

Isomeric SMILES

CC(C)CCSC1=NN(C2=C1N(C(=O)NC2=O)C)C(C)C

InChI

InChI=1S/C14H22N4O2S/c1-8(2)6-7-21-13-11-10(18(16-13)9(3)4)12(19)15-14(20)17(11)5/h8-9H,6-7H2,1-5H3,(H,15,19,20)