N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-(2-thienyl)-2-tosyl-ethyl]-3-(trifluoromethyl)benzamide Formula: C21H18F3NO3S2 MolecularWeight: 453.49773

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CS3

InChI

InChI=1S/C21H18F3NO3S2/c1-14-7-9-17(10-8-14)30(27,28)19(18-6-3-11-29-18)13-25-20(26)15-4-2-5-16(12-15)21(22,23)24/h2-12,19H,13H2,1H3,(H,25,26)