N-[2-(1,3-benzodioxol-5-yl)ethyl]pentanethioamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]pentanethioamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]pentanethioamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]pentanethioamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]pentanethioamide Traditional Name: N-homopiperonylthiovaleramide Formula: C14H19NO2S MolecularWeight: 265.37116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=S)NCCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCC(=S)NCCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H19NO2S/c1-2-3-4-14(18)15-8-7-11-5-6-12-13(9-11)17-10-16-12/h5-6,9H,2-4,7-8,10H2,1H3,(H,15,18)