2-ethyl-4-heptylsulfanyl-6-methyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-ethyl-4-heptylsulfanyl-6-methyl-pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-heptylsulfanyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-ethyl-4-(heptylthio)-6-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-ethyl-4-heptylsulfanyl-6-methylpyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-(heptylthio)-6-methyl-pyrimidine-5-carboxylic acid Formula: C15H24N2O2S MolecularWeight: 296.42826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC(=NC(=C1C(=O)O)C)CC

Isomeric SMILES

CCCCCCCSC1=NC(=NC(=C1C(=O)O)C)CC

InChI

InChI=1S/C15H24N2O2S/c1-4-6-7-8-9-10-20-14-13(15(18)19)11(3)16-12(5-2)17-14/h4-10H2,1-3H3,(H,18,19)