N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-[(4-chloro-3-nitro-phenyl)carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[(4-chloro-3-nitroanilino)-sulfanylidenemethyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-[(4-chloro-3-nitrophenyl)carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-[(4-chloro-3-nitro-phenyl)thiocarbamoyl]piazthiole-5-carboxamide Formula: C14H8ClN5O3S2 MolecularWeight: 393.82802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C=C1C(=O)NC(=S)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=NSN=C2C=C1C(=O)NC(=S)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

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