3-chloranyl-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-6-methoxy-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[4-(cyclohexylsulfamoyl)anilino]-sulfanylidenemethyl]-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[[4-(cyclohexylsulfamoyl)phenyl]thiocarbamoyl]-6-methoxy-benzothiophene-2-carboxamide Formula: C23H24ClN3O4S3 MolecularWeight: 538.10236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4CCCCC4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4CCCCC4)Cl

InChI

InChI=1S/C23H24ClN3O4S3/c1-31-16-9-12-18-19(13-16)33-21(20(18)24)22(28)26-23(32)25-14-7-10-17(11-8-14)34(29,30)27-15-5-3-2-4-6-15/h7-13,15,27H,2-6H2,1H3,(H2,25,26,28,32)