3-[(2-chlorophenyl)methyl]-2-methyl-N-pentylsulfonyl-1-benzothiophene-5-carboxamide

Systemtic Name: 3-[(2-chlorophenyl)methyl]-2-methyl-N-pentylsulfonyl-1-benzothiophene-5-carboxamide Openeye Name: 3-[(2-chlorophenyl)methyl]-2-methyl-N-pentylsulfonyl-benzothiophene-5-carboxamide CAS Name: 3-[(2-chlorophenyl)methyl]-2-methyl-N-pentylsulfonyl-1-benzothiophene-5-carboxamide IUPAC Name: 3-[(2-chlorophenyl)methyl]-2-methyl-N-pentylsulfonyl-1-benzothiophene-5-carboxamide Traditional Name: N-amylsulfonyl-3-(2-chlorobenzyl)-2-methyl-benzothiophene-5-carboxamide Formula: C22H24ClNO3S2 MolecularWeight: 450.01386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)SC(=C2CC3=CC=CC=C3Cl)C

Isomeric SMILES

CCCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)SC(=C2CC3=CC=CC=C3Cl)C

InChI

InChI=1S/C22H24ClNO3S2/c1-3-4-7-12-29(26,27)24-22(25)17-10-11-21-19(14-17)18(15(2)28-21)13-16-8-5-6-9-20(16)23/h5-6,8-11,14H,3-4,7,12-13H2,1-2H3,(H,24,25)