3,6-bis(chloranyl)-N-[(4-chloranyl-2-nitro-phenyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[(4-chloranyl-2-nitro-phenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(4-chloro-2-nitro-phenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[(4-chloro-2-nitroanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(4-chloro-2-nitrophenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(4-chloro-2-nitro-phenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C16H8Cl3N3O3S2 MolecularWeight: 460.74202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)SC(=C2Cl)C(=O)NC(=S)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)SC(=C2Cl)C(=O)NC(=S)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H8Cl3N3O3S2/c17-7-2-4-10(11(5-7)22(24)25)20-16(26)21-15(23)14-13(19)9-3-1-8(18)6-12(9)27-14/h1-6H,(H2,20,21,23,26)