6-propyl-2-(pyridin-2-ylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-propyl-2-(pyridin-2-ylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-propyl-2-(2-pyridylmethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-propyl-2-(2-pyridinylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-propyl-2-(pyridin-2-ylmethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 6-propyl-2-(2-pyridylmethylthio)-1H-pyrimidin-4-one Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=CC=CC=N2

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=CC=CC=N2

InChI

InChI=1S/C13H15N3OS/c1-2-5-10-8-12(17)16-13(15-10)18-9-11-6-3-4-7-14-11/h3-4,6-8H,2,5,9H2,1H3,(H,15,16,17)