1-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]propan-1-one

Systemtic Name: 1-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]propan-1-one Openeye Name: 1-[2-(3-pyridylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]propan-1-one CAS Name: 1-[2-(3-pyridinylmethylthio)-4,5-dihydroimidazol-1-yl]-1-propanone IUPAC Name: 1-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]propan-1-one Traditional Name: 1-[2-(3-pyridylmethylthio)-2-imidazolin-1-yl]propan-1-one Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN=C1SCC2=CN=CC=C2

Isomeric SMILES

CCC(=O)N1CCN=C1SCC2=CN=CC=C2

InChI

InChI=1S/C12H15N3OS/c1-2-11(16)15-7-6-14-12(15)17-9-10-4-3-5-13-8-10/h3-5,8H,2,6-7,9H2,1H3