N-(1,3-benzodioxol-5-yl)azocane-1-carbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)azocane-1-carbothioamide Openeye Name: N-(1,3-benzodioxol-5-yl)azocane-1-carbothioamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-azocanecarbothioamide IUPAC Name: N-(1,3-benzodioxol-5-yl)azocane-1-carbothioamide Traditional Name: N-(1,3-benzodioxol-5-yl)azocane-1-carbothioamide Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCCN(CCC1)C(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H20N2O2S/c20-15(17-8-4-2-1-3-5-9-17)16-12-6-7-13-14(10-12)19-11-18-13/h6-7,10H,1-5,8-9,11H2,(H,16,20)