6-methyl-2-phenethylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-phenethylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-methyl-2-phenethylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-(phenethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-phenethylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-methyl-2-(phenethylthio)-1H-pyrimidin-4-one Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCCC2=CC=CC=C2

InChI

InChI=1S/C13H14N2OS/c1-10-9-12(16)15-13(14-10)17-8-7-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3,(H,14,15,16)