2-cyclopropyl-4-methyl-6-(thiophen-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopropyl-4-methyl-6-(thiophen-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-methyl-6-(2-thienylmethylsulfanyl)pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-methyl-6-(thiophen-2-ylmethylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-methyl-6-(thiophen-2-ylmethylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-methyl-6-(2-thenylthio)pyrimidine-5-carboxylic acid Formula: C14H14N2O2S2 MolecularWeight: 306.40316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC3=CC=CS3)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC3=CC=CS3)C(=O)O

InChI

InChI=1S/C14H14N2O2S2/c1-8-11(14(17)18)13(16-12(15-8)9-4-5-9)20-7-10-3-2-6-19-10/h2-3,6,9H,4-5,7H2,1H3,(H,17,18)