2-ethyl-4-methyl-6-prop-2-enylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: 2-ethyl-4-methyl-6-prop-2-enylsulfanyl-pyrimidine-5-carboxylate Openeye Name: 4-allylsulfanyl-2-ethyl-6-methyl-pyrimidine-5-carboxylate CAS Name: 2-ethyl-4-methyl-6-(prop-2-enylthio)-5-pyrimidinecarboxylate IUPAC Name: 2-ethyl-4-methyl-6-prop-2-enylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(allylthio)-2-ethyl-6-methyl-pyrimidine-5-carboxylate Formula: C11H13N2O2S- MolecularWeight: 237.29812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O2S/c1-4-6-16-10-9(11(14)15)7(3)12-8(5-2)13-10/h4H,1,5-6H2,2-3H3,(H,14,15)/p-1