2-cyclopentyl-4-methyl-6-prop-2-enylsulfanyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-cyclopentyl-4-methyl-6-prop-2-enylsulfanyl-pyrimidine-5-carboxylic acid Openeye Name: 4-allylsulfanyl-2-cyclopentyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-cyclopentyl-4-methyl-6-(prop-2-enylthio)-5-pyrimidinecarboxylic acid IUPAC Name: 2-cyclopentyl-4-methyl-6-prop-2-enylsulfanylpyrimidine-5-carboxylic acid Traditional Name: 4-(allylthio)-2-cyclopentyl-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CCCC2)SCC=C)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CCCC2)SCC=C)C(=O)O

InChI

InChI=1S/C14H18N2O2S/c1-3-8-19-13-11(14(17)18)9(2)15-12(16-13)10-6-4-5-7-10/h3,10H,1,4-8H2,2H3,(H,17,18)