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

Systemtic Name: 2-cyclopropyl-4-methyl-6-prop-2-enylsulfanyl-pyrimidine-5-carboxylate Openeye Name: 4-allylsulfanyl-2-cyclopropyl-6-methyl-pyrimidine-5-carboxylate CAS Name: 2-cyclopropyl-4-methyl-6-(prop-2-enylthio)-5-pyrimidinecarboxylate IUPAC Name: 2-cyclopropyl-4-methyl-6-prop-2-enylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(allylthio)-2-cyclopropyl-6-methyl-pyrimidine-5-carboxylate Formula: C12H13N2O2S- MolecularWeight: 249.30882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC=C)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC=C)C(=O)[O-]

InChI

InChI=1S/C12H14N2O2S/c1-3-6-17-11-9(12(15)16)7(2)13-10(14-11)8-4-5-8/h3,8H,1,4-6H2,2H3,(H,15,16)/p-1