2-methylsulfanyl-1-propan-2-yl-2H-pyrimidine-5-carboxylic acid

Systemtic Name: 2-methylsulfanyl-1-propan-2-yl-2H-pyrimidine-5-carboxylic acid Openeye Name: 1-isopropyl-2-methylsulfanyl-2H-pyrimidine-5-carboxylic acid CAS Name: 2-(methylthio)-1-propan-2-yl-2H-pyrimidine-5-carboxylic acid IUPAC Name: 2-methylsulfanyl-1-propan-2-yl-2H-pyrimidine-5-carboxylic acid Traditional Name: 1-isopropyl-2-(methylthio)-2H-pyrimidine-5-carboxylic acid Formula: C9H14N2O2S MolecularWeight: 214.28466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=NC1SC)C(=O)O

Isomeric SMILES

CC(C)N1C=C(C=NC1SC)C(=O)O

InChI

InChI=1S/C9H14N2O2S/c1-6(2)11-5-7(8(12)13)4-10-9(11)14-3/h4-6,9H,1-3H3,(H,12,13)