5-[(6-methylpyridin-3-yl)methyl]-2-phenethylsulfanyl-1H-pyrimidin-6-one

Systemtic Name: 5-[(6-methylpyridin-3-yl)methyl]-2-phenethylsulfanyl-1H-pyrimidin-6-one Openeye Name: 5-[(6-methyl-3-pyridyl)methyl]-2-phenethylsulfanyl-1H-pyrimidin-6-one CAS Name: 5-[(6-methyl-3-pyridinyl)methyl]-2-(phenethylthio)-1H-pyrimidin-6-one IUPAC Name: 5-[(6-methylpyridin-3-yl)methyl]-2-phenethylsulfanyl-1H-pyrimidin-6-one Traditional Name: 5-[(6-methyl-3-pyridyl)methyl]-2-(phenethylthio)-1H-pyrimidin-6-one Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)SCCC3=CC=CC=C3

Isomeric SMILES

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)SCCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3OS/c1-14-7-8-16(12-20-14)11-17-13-21-19(22-18(17)23)24-10-9-15-5-3-2-4-6-15/h2-8,12-13H,9-11H2,1H3,(H,21,22,23)