2-cyclopropyl-4-methyl-6-(3-methylbut-2-enylsulfanyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopropyl-4-methyl-6-(3-methylbut-2-enylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2-cyclopropyl-4-methyl-6-(3-methylbut-2-enylsulfanyl)pyrimidine-5-carboxylic acid CAS Name: 2-cyclopropyl-4-methyl-6-(3-methylbut-2-enylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopropyl-4-methyl-6-(3-methylbut-2-enylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2-cyclopropyl-4-methyl-6-(3-methylbut-2-enylthio)pyrimidine-5-carboxylic acid Formula: C14H18N2O2S MolecularWeight: 278.36992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC=C(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC=C(C)C)C(=O)O

InChI

InChI=1S/C14H18N2O2S/c1-8(2)6-7-19-13-11(14(17)18)9(3)15-12(16-13)10-4-5-10/h6,10H,4-5,7H2,1-3H3,(H,17,18)