2-cyclopropyl-4-methyl-6-(1,2,4-oxadiazol-5-ylmethylsulfanyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopropyl-4-methyl-6-(1,2,4-oxadiazol-5-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-methyl-6-(1,2,4-oxadiazol-5-ylmethylsulfanyl)pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-methyl-6-(1,2,4-oxadiazol-5-ylmethylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-methyl-6-(1,2,4-oxadiazol-5-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-methyl-6-(1,2,4-oxadiazol-5-ylmethylthio)pyrimidine-5-carboxylic acid Formula: C12H12N4O3S MolecularWeight: 292.31368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC3=NC=NO3)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC3=NC=NO3)C(=O)O

InChI

InChI=1S/C12H12N4O3S/c1-6-9(12(17)18)11(16-10(15-6)7-2-3-7)20-4-8-13-5-14-19-8/h5,7H,2-4H2,1H3,(H,17,18)