4-ethoxy-5-(phenylmethylsulfanyl)-1H-pyrimidin-6-one

Systemtic Name: 4-ethoxy-5-(phenylmethylsulfanyl)-1H-pyrimidin-6-one Openeye Name: 5-benzylsulfanyl-4-ethoxy-1H-pyrimidin-6-one CAS Name: 4-ethoxy-5-(phenylmethylthio)-1H-pyrimidin-6-one IUPAC Name: 5-benzylsulfanyl-4-ethoxy-1H-pyrimidin-6-one Traditional Name: 5-(benzylthio)-4-ethoxy-1H-pyrimidin-6-one Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)NC=N1)SCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=O)NC=N1)SCC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2S/c1-2-17-13-11(12(16)14-9-15-13)18-8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H,14,15,16)