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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C

InChI

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