N-[3-(azepan-1-yl)propyl]-2-phenylsulfanyl-propanamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-phenylsulfanyl-propanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-phenylsulfanyl-propanamide CAS Name: N-[3-(1-azepanyl)propyl]-2-(phenylthio)propanamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-phenylsulfanylpropanamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(phenylthio)propionamide Formula: C18H28N2OS MolecularWeight: 320.49272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCN1CCCCCC1)SC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NCCCN1CCCCCC1)SC2=CC=CC=C2

InChI

InChI=1S/C18H28N2OS/c1-16(22-17-10-5-4-6-11-17)18(21)19-12-9-15-20-13-7-2-3-8-14-20/h4-6,10-11,16H,2-3,7-9,12-15H2,1H3,(H,19,21)