4,6-dimethyl-2-(phenylmethylsulfanyl)pyrimidin-5-ol

Systemtic Name: 4,6-dimethyl-2-(phenylmethylsulfanyl)pyrimidin-5-ol Openeye Name: 2-benzylsulfanyl-4,6-dimethyl-pyrimidin-5-ol CAS Name: 4,6-dimethyl-2-(phenylmethylthio)-5-pyrimidinol IUPAC Name: 2-benzylsulfanyl-4,6-dimethylpyrimidin-5-ol Traditional Name: 2-(benzylthio)-4,6-dimethyl-pyrimidin-5-ol Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SCC2=CC=CC=C2)C)O

Isomeric SMILES

CC1=C(C(=NC(=N1)SCC2=CC=CC=C2)C)O

InChI

InChI=1S/C13H14N2OS/c1-9-12(16)10(2)15-13(14-9)17-8-11-6-4-3-5-7-11/h3-7,16H,8H2,1-2H3