3-chloranyl-6-fluoranyl-N-[(4-sulfamoylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-fluoranyl-N-[(4-sulfamoylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-fluoro-N-[(4-sulfamoylphenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-fluoro-N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-fluoro-N-[(4-sulfamoylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-fluoro-N-[(4-sulfamoylphenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C16H11ClFN3O3S3 MolecularWeight: 443.923243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)S(=O)(=O)N

InChI

InChI=1S/C16H11ClFN3O3S3/c17-13-11-6-1-8(18)7-12(11)26-14(13)15(22)21-16(25)20-9-2-4-10(5-3-9)27(19,23)24/h1-7H,(H2,19,23,24)(H2,20,21,22,25)