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

Systemtic Name: 3-chloranyl-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[4-(phenethylsulfamoyl)anilino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[[4-(phenethylsulfamoyl)phenyl]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C24H20ClN3O3S3 MolecularWeight: 530.0819

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C24H20ClN3O3S3/c25-21-19-8-4-5-9-20(19)33-22(21)23(29)28-24(32)27-17-10-12-18(13-11-17)34(30,31)26-15-14-16-6-2-1-3-7-16/h1-13,26H,14-15H2,(H2,27,28,29,32)