N-(3-methylsulfanylpropyl)azepane-1-carbothioamide

Systemtic Name: N-(3-methylsulfanylpropyl)azepane-1-carbothioamide Openeye Name: N-(3-methylsulfanylpropyl)azepane-1-carbothioamide CAS Name: N-[3-(methylthio)propyl]-1-azepanecarbothioamide IUPAC Name: N-(3-methylsulfanylpropyl)azepane-1-carbothioamide Traditional Name: N-[3-(methylthio)propyl]azepane-1-carbothioamide Formula: C11H22N2S2 MolecularWeight: 246.43578

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)N1CCCCCC1

Isomeric SMILES

CSCCCNC(=S)N1CCCCCC1

InChI

InChI=1S/C11H22N2S2/c1-15-10-6-7-12-11(14)13-8-4-2-3-5-9-13/h2-10H2,1H3,(H,12,14)