N-[(pyridin-4-ylcarbonylamino)carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(pyridin-4-ylcarbonylamino)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(pyridine-4-carbonylamino)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(pyridine-4-carbonylamino)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(isonicotinamidothiocarbamoyl)-piperonylamide Formula: C15H12N4O4S MolecularWeight: 344.34518

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NNC(=O)C3=CC=NC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C15H12N4O4S/c20-13(10-1-2-11-12(7-10)23-8-22-11)17-15(24)19-18-14(21)9-3-5-16-6-4-9/h1-7H,8H2,(H,18,21)(H2,17,19,20,24)