4-methyl-6-(3-methylbutylsulfanyl)-2-propan-2-yl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-methyl-6-(3-methylbutylsulfanyl)-2-propan-2-yl-pyrimidine-5-carboxylic acid Openeye Name: 4-isopentylsulfanyl-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 4-methyl-6-(3-methylbutylthio)-2-propan-2-yl-5-pyrimidinecarboxylic acid IUPAC Name: 4-methyl-6-(3-methylbutylsulfanyl)-2-propan-2-ylpyrimidine-5-carboxylic acid Traditional Name: 4-(isoamylthio)-2-isopropyl-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H22N2O2S MolecularWeight: 282.40168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C(C)C)SCCC(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C(C)C)SCCC(C)C)C(=O)O

InChI

InChI=1S/C14H22N2O2S/c1-8(2)6-7-19-13-11(14(17)18)10(5)15-12(16-13)9(3)4/h8-9H,6-7H2,1-5H3,(H,17,18)