N-[(5-iodanylpyridin-2-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(5-iodanylpyridin-2-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(5-iodo-2-pyridyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[(5-iodo-2-pyridinyl)amino]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(5-iodopyridin-2-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(5-iodo-2-pyridyl)thiocarbamoyl]-piperonylamide Formula: C14H10IN3O3S MolecularWeight: 427.21697

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=NC=C(C=C3)I

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=NC=C(C=C3)I

InChI

InChI=1S/C14H10IN3O3S/c15-9-2-4-12(16-6-9)17-14(22)18-13(19)8-1-3-10-11(5-8)21-7-20-10/h1-6H,7H2,(H2,16,17,18,19,22)