3-chloranyl-N-[[4-(dimethylsulfamoyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[4-(dimethylsulfamoyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[4-(dimethylsulfamoyl)phenyl]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[4-(dimethylsulfamoyl)anilino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[4-(dimethylsulfamoyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[[4-(dimethylsulfamoyl)phenyl]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C18H16ClN3O3S3 MolecularWeight: 453.98594

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C18H16ClN3O3S3/c1-22(2)28(24,25)12-9-7-11(8-10-12)20-18(26)21-17(23)16-15(19)13-5-3-4-6-14(13)27-16/h3-10H,1-2H3,(H2,20,21,23,26)