N-(2-methylsulfanylphenyl)azepane-1-carboxamide

Systemtic Name: N-(2-methylsulfanylphenyl)azepane-1-carboxamide Openeye Name: N-(2-methylsulfanylphenyl)azepane-1-carboxamide CAS Name: N-[2-(methylthio)phenyl]-1-azepanecarboxamide IUPAC Name: N-(2-methylsulfanylphenyl)azepane-1-carboxamide Traditional Name: N-[2-(methylthio)phenyl]azepane-1-carboxamide Formula: C14H20N2OS MolecularWeight: 264.3864

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)N2CCCCCC2

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)N2CCCCCC2

InChI

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