5-[(4-methylphenyl)methyl-methylsulfonyl-amino]-N-[3-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-methylphenyl)methyl-methylsulfonyl-amino]-N-[3-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 5-[methylsulfonyl(p-tolylmethyl)amino]-N-[3-(trifluoromethyl)phenyl]benzothiophene-2-carboxamide CAS Name: 5-[(4-methylphenyl)methyl-methylsulfonylamino]-N-[3-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-methylphenyl)methyl-methylsulfonylamino]-N-[3-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 5-[mesyl-(4-methylbenzyl)amino]-N-[3-(trifluoromethyl)phenyl]benzothiophene-2-carboxamide Formula: C25H21F3N2O3S2 MolecularWeight: 518.57105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F)S(=O)(=O)C

InChI

InChI=1S/C25H21F3N2O3S2/c1-16-6-8-17(9-7-16)15-30(35(2,32)33)21-10-11-22-18(12-21)13-23(34-22)24(31)29-20-5-3-4-19(14-20)25(26,27)28/h3-14H,15H2,1-2H3,(H,29,31)