N-[4-(butan-2-ylsulfamoyl)phenyl]-1-chloranyl-benzo[e][1]benzothiole-2-carboxamide

Systemtic Name: N-[4-(butan-2-ylsulfamoyl)phenyl]-1-chloranyl-benzo[e][1]benzothiole-2-carboxamide Openeye Name: 1-chloro-N-[4-(sec-butylsulfamoyl)phenyl]benzo[e]benzothiophene-2-carboxamide CAS Name: N-[4-(butan-2-ylsulfamoyl)phenyl]-1-chloro-2-benzo[e][1]benzothiolecarboxamide IUPAC Name: N-[4-(butan-2-ylsulfamoyl)phenyl]-1-chlorobenzo[e][1]benzothiole-2-carboxamide Traditional Name: 1-chloro-N-[4-(sec-butylsulfamoyl)phenyl]benzo[e]benzothiophene-2-carboxamide Formula: C23H21ClN2O3S2 MolecularWeight: 473.00744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C23H21ClN2O3S2/c1-3-14(2)26-31(28,29)17-11-9-16(10-12-17)25-23(27)22-21(24)20-18-7-5-4-6-15(18)8-13-19(20)30-22/h4-14,26H,3H2,1-2H3,(H,25,27)