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

Systemtic Name: 3,6-bis(chloranyl)-N-[[4-(ethanoylsulfamoyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-3,6-dichloro-benzothiophene-2-carboxamide CAS Name: N-[[4-(acetylsulfamoyl)anilino]-sulfanylidenemethyl]-3,6-dichloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-3,6-dichloro-1-benzothiophene-2-carboxamide Traditional Name: N-[[4-(acetylsulfamoyl)phenyl]thiocarbamoyl]-3,6-dichloro-benzothiophene-2-carboxamide Formula: C18H13Cl2N3O4S3 MolecularWeight: 502.41452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H13Cl2N3O4S3/c1-9(24)23-30(26,27)12-5-3-11(4-6-12)21-18(28)22-17(25)16-15(20)13-7-2-10(19)8-14(13)29-16/h2-8H,1H3,(H,23,24)(H2,21,22,25,28)