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

Systemtic Name: 4-methyl-6-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]-2-propan-2-yl-pyrimidine-5-carboxylic acid Openeye Name: 2-isopropyl-4-methyl-6-[(3-methylisoxazol-5-yl)methylsulfanyl]pyrimidine-5-carboxylic acid CAS Name: 4-methyl-6-[(3-methyl-5-isoxazolyl)methylthio]-2-propan-2-yl-5-pyrimidinecarboxylic acid IUPAC Name: 4-methyl-6-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]-2-propan-2-ylpyrimidine-5-carboxylic acid Traditional Name: 2-isopropyl-4-methyl-6-[(3-methylisoxazol-5-yl)methylthio]pyrimidine-5-carboxylic acid Formula: C14H17N3O3S MolecularWeight: 307.36808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=NC(=NC(=C2C(=O)O)C)C(C)C

Isomeric SMILES

CC1=NOC(=C1)CSC2=NC(=NC(=C2C(=O)O)C)C(C)C

InChI

InChI=1S/C14H17N3O3S/c1-7(2)12-15-9(4)11(14(18)19)13(16-12)21-6-10-5-8(3)17-20-10/h5,7H,6H2,1-4H3,(H,18,19)