2-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-ethanethione

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-ethanethione Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-ethanethione CAS Name: 2-(1,3-benzodioxol-5-yl)-1-(1-pyrrolidinyl)ethanethione IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-ylethanethione Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-pyrrolidino-ethanethione Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCN(C1)C(=S)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H15NO2S/c17-13(14-5-1-2-6-14)8-10-3-4-11-12(7-10)16-9-15-11/h3-4,7H,1-2,5-6,8-9H2