1-(azepan-1-yl)-2-tert-butylsulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-tert-butylsulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-tert-butylsulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-(tert-butylthio)ethanone IUPAC Name: 1-(azepan-1-yl)-2-tert-butylsulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-(tert-butylthio)ethanone Formula: C12H23NOS MolecularWeight: 229.38212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=O)N1CCCCCC1

Isomeric SMILES

CC(C)(C)SCC(=O)N1CCCCCC1

InChI

InChI=1S/C12H23NOS/c1-12(2,3)15-10-11(14)13-8-6-4-5-7-9-13/h4-10H2,1-3H3