3-pyridin-2-ylsulfanylazepan-2-one

Systemtic Name: 3-pyridin-2-ylsulfanylazepan-2-one Openeye Name: 3-(2-pyridylsulfanyl)azepan-2-one CAS Name: 3-(2-pyridinylthio)-2-azepanone IUPAC Name: 3-pyridin-2-ylsulfanylazepan-2-one Traditional Name: 3-(2-pyridylthio)azepan-2-one Formula: C11H14N2OS MolecularWeight: 222.30666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)SC2=CC=CC=N2

Isomeric SMILES

C1CCNC(=O)C(C1)SC2=CC=CC=N2

InChI

InChI=1S/C11H14N2OS/c14-11-9(5-1-3-8-13-11)15-10-6-2-4-7-12-10/h2,4,6-7,9H,1,3,5,8H2,(H,13,14)