N-[(2-nitrophenyl)carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-[(2-nitrophenyl)carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-[(2-nitrophenyl)carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[(2-nitroanilino)-sulfanylidenemethyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-[(2-nitrophenyl)carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-[(2-nitrophenyl)thiocarbamoyl]piazthiole-5-carboxamide Formula: C14H9N5O3S2 MolecularWeight: 359.38296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=S)NC(=O)C2=CC3=NSN=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NC(=S)NC(=O)C2=CC3=NSN=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O3S2/c20-13(8-5-6-9-11(7-8)18-24-17-9)16-14(23)15-10-3-1-2-4-12(10)19(21)22/h1-7H,(H2,15,16,20,23)