2-[(3-methylphenyl)methylsulfanyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(3-methylphenyl)methylsulfanyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-2-(m-tolylmethylsulfanyl)-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-[(3-methylphenyl)methylthio]-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-2-[(3-methylphenyl)methylsulfanyl]-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-[(3-methylbenzyl)thio]-1H-pyrimidin-6-one Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC(=CC(=O)N2)O

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC(=CC(=O)N2)O

InChI

InChI=1S/C12H12N2O2S/c1-8-3-2-4-9(5-8)7-17-12-13-10(15)6-11(16)14-12/h2-6H,7H2,1H3,(H2,13,14,15,16)