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

Systemtic Name: N-[(3-nitrophenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(3-nitrophenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(3-nitroanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(3-nitrophenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(3-nitrophenyl)thiocarbamoyl]-piperonylamide Formula: C15H11N3O5S MolecularWeight: 345.32994

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O5S/c19-14(9-4-5-12-13(6-9)23-8-22-12)17-15(24)16-10-2-1-3-11(7-10)18(20)21/h1-7H,8H2,(H2,16,17,19,24)