5-tert-butyl-N-[[3-(methylsulfamoyl)phenyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: 5-tert-butyl-N-[[3-(methylsulfamoyl)phenyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-tert-butyl-N-[[3-(methylsulfamoyl)phenyl]methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-tert-butyl-N-[[3-(methylsulfamoyl)phenyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-tert-butyl-N-[[3-(methylsulfamoyl)phenyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-tert-butyl-N-[3-(methylsulfamoyl)benzyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC(=CC=C3)S(=O)(=O)NC

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC(=CC=C3)S(=O)(=O)NC

InChI

InChI=1S/C21H28N2O3S2/c1-21(2,3)16-8-9-18-15(11-16)12-19(27-18)20(24)23-13-14-6-5-7-17(10-14)28(25,26)22-4/h5-7,10,12,16,22H,8-9,11,13H2,1-4H3,(H,23,24)