N-[[(4-nitrophenyl)amino]carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[(4-nitrophenyl)amino]carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(4-nitroanilino)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[(4-nitrophenyl)hydrazo]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(4-nitroanilino)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(4-nitroanilino)thiocarbamoyl]-piperonylamide Formula: C15H12N4O5S MolecularWeight: 360.34458

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O5S/c20-14(9-1-6-12-13(7-9)24-8-23-12)16-15(25)18-17-10-2-4-11(5-3-10)19(21)22/h1-7,17H,8H2,(H2,16,18,20,25)