5-[(2-methoxypyridin-4-yl)methyl]-1-methyl-2-(phenylmethylsulfanyl)pyrimidin-4-one

Systemtic Name: 5-[(2-methoxypyridin-4-yl)methyl]-1-methyl-2-(phenylmethylsulfanyl)pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-5-[(2-methoxy-4-pyridyl)methyl]-1-methyl-pyrimidin-4-one CAS Name: 5-[(2-methoxy-4-pyridinyl)methyl]-1-methyl-2-(phenylmethylthio)-4-pyrimidinone IUPAC Name: 2-benzylsulfanyl-5-[(2-methoxypyridin-4-yl)methyl]-1-methylpyrimidin-4-one Traditional Name: 2-(benzylthio)-5-[(2-methoxy-4-pyridyl)methyl]-1-methyl-pyrimidin-4-one Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N=C1SCC2=CC=CC=C2)CC3=CC(=NC=C3)OC

Isomeric SMILES

CN1C=C(C(=O)N=C1SCC2=CC=CC=C2)CC3=CC(=NC=C3)OC

InChI

InChI=1S/C19H19N3O2S/c1-22-12-16(10-15-8-9-20-17(11-15)24-2)18(23)21-19(22)25-13-14-6-4-3-5-7-14/h3-9,11-12H,10,13H2,1-2H3