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

Systemtic Name: N-(butylcarbamothioyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(butylcarbamothioyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[butylamino(sulfanylidene)methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(butylcarbamothioyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(butylthiocarbamoyl)-piperonylamide Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O3S/c1-2-3-6-14-13(19)15-12(16)9-4-5-10-11(7-9)18-8-17-10/h4-5,7H,2-3,6,8H2,1H3,(H2,14,15,16,19)