N-[[(3,4,5-trimethoxyphenyl)carbonylamino]carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[(3,4,5-trimethoxyphenyl)carbonylamino]carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[(3,4,5-trimethoxybenzoyl)amino]carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[[oxo-(3,4,5-trimethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[(3,4,5-trimethoxybenzoyl)amino]carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[(3,4,5-trimethoxybenzoyl)amino]thiocarbamoyl]-piperonylamide Formula: C19H19N3O7S MolecularWeight: 433.43506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=S)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=S)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H19N3O7S/c1-25-14-7-11(8-15(26-2)16(14)27-3)18(24)21-22-19(30)20-17(23)10-4-5-12-13(6-10)29-9-28-12/h4-8H,9H2,1-3H3,(H,21,24)(H2,20,22,23,30)