4-(2-hydroxyethylsulfanyl)-2,6-dimethyl-pyrimidine-5-carboxylate

Systemtic Name: 4-(2-hydroxyethylsulfanyl)-2,6-dimethyl-pyrimidine-5-carboxylate Openeye Name: 4-(2-hydroxyethylsulfanyl)-2,6-dimethyl-pyrimidine-5-carboxylate CAS Name: 4-(2-hydroxyethylthio)-2,6-dimethyl-5-pyrimidinecarboxylate IUPAC Name: 4-(2-hydroxyethylsulfanyl)-2,6-dimethylpyrimidine-5-carboxylate Traditional Name: 4-(2-hydroxyethylthio)-2,6-dimethyl-pyrimidine-5-carboxylate Formula: C9H11N2O3S- MolecularWeight: 227.26024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O3S/c1-5-7(9(13)14)8(15-4-3-12)11-6(2)10-5/h12H,3-4H2,1-2H3,(H,13,14)/p-1