N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-3-nitro-benzamide CAS Name: N-[[(5-chloro-2,1,3-benzothiadiazol-4-yl)amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[(5-chloropiazthiol-4-yl)thiocarbamoyl]-3-nitro-benzamide Formula: C14H8ClN5O3S2 MolecularWeight: 393.82802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=C(C=CC3=NSN=C32)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=C(C=CC3=NSN=C32)Cl

InChI

InChI=1S/C14H8ClN5O3S2/c15-9-4-5-10-12(19-25-18-10)11(9)16-14(24)17-13(21)7-2-1-3-8(6-7)20(22)23/h1-6H,(H2,16,17,21,24)