2-(phenylmethylsulfanyl)-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-(phenylmethylsulfanyl)-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-(phenylmethylthio)-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-benzylsulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-(benzylthio)-6-propyl-1H-pyrimidin-4-one Formula: C14H16N2OS MolecularWeight: 260.35464

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=CC=CC=C2

InChI

InChI=1S/C14H16N2OS/c1-2-6-12-9-13(17)16-14(15-12)18-10-11-7-4-3-5-8-11/h3-5,7-9H,2,6,10H2,1H3,(H,15,16,17)