5-methyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-one

Systemtic Name: 5-methyl-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-one Openeye Name: 2-benzylsulfanyl-5-methyl-1H-pyrimidin-6-one CAS Name: 5-methyl-2-(phenylmethylthio)-1H-pyrimidin-6-one IUPAC Name: 2-benzylsulfanyl-5-methyl-1H-pyrimidin-6-one Traditional Name: 2-(benzylthio)-5-methyl-1H-pyrimidin-6-one Formula: C12H12N2OS MolecularWeight: 232.30148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(NC1=O)SCC2=CC=CC=C2

Isomeric SMILES

CC1=CN=C(NC1=O)SCC2=CC=CC=C2

InChI

InChI=1S/C12H12N2OS/c1-9-7-13-12(14-11(9)15)16-8-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,13,14,15)