N-(2-methylpropylcarbamothioyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(2-methylpropylcarbamothioyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(isobutylcarbamothioyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[(2-methylpropylamino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(2-methylpropylcarbamothioyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(isobutylthiocarbamoyl)-piperonylamide Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=S)NC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)CNC(=S)NC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C13H16N2O3S/c1-8(2)6-14-13(19)15-12(16)9-3-4-10-11(5-9)18-7-17-10/h3-5,8H,6-7H2,1-2H3,(H2,14,15,16,19)