2-ethyl-4-methyl-6-(2-methylpropylsulfanyl)pyrimidine-5-carboxylate

Systemtic Name: 2-ethyl-4-methyl-6-(2-methylpropylsulfanyl)pyrimidine-5-carboxylate Openeye Name: 2-ethyl-4-isobutylsulfanyl-6-methyl-pyrimidine-5-carboxylate CAS Name: 2-ethyl-4-methyl-6-(2-methylpropylthio)-5-pyrimidinecarboxylate IUPAC Name: 2-ethyl-4-methyl-6-(2-methylpropylsulfanyl)pyrimidine-5-carboxylate Traditional Name: 2-ethyl-4-(isobutylthio)-6-methyl-pyrimidine-5-carboxylate Formula: C12H17N2O2S- MolecularWeight: 253.34058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCC(C)C)C(=O)[O-])C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCC(C)C)C(=O)[O-])C

InChI

InChI=1S/C12H18N2O2S/c1-5-9-13-8(4)10(12(15)16)11(14-9)17-6-7(2)3/h7H,5-6H2,1-4H3,(H,15,16)/p-1