6-methyl-2-oxidanylidene-4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-2-oxidanylidene-4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-pyrimidine-5-carboxylic acid Openeye Name: 4-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-2-oxo-4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylthio]-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-2-oxo-4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methylthio]-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC2=NC(=NO2)C(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC2=NC(=NO2)C(C)C)C(=O)O

InChI

InChI=1S/C12H14N4O4S/c1-5(2)9-14-7(20-16-9)4-21-10-8(11(17)18)6(3)13-12(19)15-10/h5H,4H2,1-3H3,(H,17,18)(H,13,15,19)