4-cyclohexylsulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-cyclohexylsulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid Openeye Name: 4-cyclohexylsulfanyl-2,6-dimethyl-pyrimidine-5-carboxylic acid CAS Name: 4-(cyclohexylthio)-2,6-dimethyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-cyclohexylsulfanyl-2,6-dimethylpyrimidine-5-carboxylic acid Traditional Name: 4-(cyclohexylthio)-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SC2CCCCC2)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SC2CCCCC2)C(=O)O

InChI

InChI=1S/C13H18N2O2S/c1-8-11(13(16)17)12(15-9(2)14-8)18-10-6-4-3-5-7-10/h10H,3-7H2,1-2H3,(H,16,17)