N-(3-ethoxypropylcarbamothioyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(3-ethoxypropylcarbamothioyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(3-ethoxypropylcarbamothioyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[(3-ethoxypropylamino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(3-ethoxypropylcarbamothioyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(3-ethoxypropylthiocarbamoyl)-piperonylamide Formula: C14H18N2O4S MolecularWeight: 310.36872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCOCCCNC(=S)NC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H18N2O4S/c1-2-18-7-3-6-15-14(21)16-13(17)10-4-5-11-12(8-10)20-9-19-11/h4-5,8H,2-3,6-7,9H2,1H3,(H2,15,16,17,21)