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

Systemtic Name: 4-(2-hydroxyethylsulfanyl)-6-methyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: 4-(2-hydroxyethylsulfanyl)-6-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-(2-hydroxyethylthio)-6-methyl-2-phenyl-5-pyrimidinecarboxylate IUPAC Name: 4-(2-hydroxyethylsulfanyl)-6-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(2-hydroxyethylthio)-6-methyl-2-phenyl-pyrimidine-5-carboxylate Formula: C14H13N2O3S- MolecularWeight: 289.32962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCCO)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCCO)C(=O)[O-]

InChI

InChI=1S/C14H14N2O3S/c1-9-11(14(18)19)13(20-8-7-17)16-12(15-9)10-5-3-2-4-6-10/h2-6,17H,7-8H2,1H3,(H,18,19)/p-1