1-(azepan-1-yl)-2-pyridin-2-ylsulfanyl-propan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-pyridin-2-ylsulfanyl-propan-1-one Openeye Name: 1-(azepan-1-yl)-2-(2-pyridylsulfanyl)propan-1-one CAS Name: 1-(1-azepanyl)-2-(2-pyridinylthio)-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-pyridin-2-ylsulfanylpropan-1-one Traditional Name: 1-(azepan-1-yl)-2-(2-pyridylthio)propan-1-one Formula: C14H20N2OS MolecularWeight: 264.3864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)SC2=CC=CC=N2

Isomeric SMILES

CC(C(=O)N1CCCCCC1)SC2=CC=CC=N2

InChI

InChI=1S/C14H20N2OS/c1-12(18-13-8-4-5-9-15-13)14(17)16-10-6-2-3-7-11-16/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3