2-cyclopentyl-4-(2-hydroxyethylsulfanyl)-6-methyl-pyrimidine-5-carboxylate

Systemtic Name: 2-cyclopentyl-4-(2-hydroxyethylsulfanyl)-6-methyl-pyrimidine-5-carboxylate Openeye Name: 2-cyclopentyl-4-(2-hydroxyethylsulfanyl)-6-methyl-pyrimidine-5-carboxylate CAS Name: 2-cyclopentyl-4-(2-hydroxyethylthio)-6-methyl-5-pyrimidinecarboxylate IUPAC Name: 2-cyclopentyl-4-(2-hydroxyethylsulfanyl)-6-methylpyrimidine-5-carboxylate Traditional Name: 2-cyclopentyl-4-(2-hydroxyethylthio)-6-methyl-pyrimidine-5-carboxylate Formula: C13H17N2O3S- MolecularWeight: 281.35068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CCCC2)SCCO)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CCCC2)SCCO)C(=O)[O-]

InChI

InChI=1S/C13H18N2O3S/c1-8-10(13(17)18)12(19-7-6-16)15-11(14-8)9-4-2-3-5-9/h9,16H,2-7H2,1H3,(H,17,18)/p-1