N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-2-[3-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-2-[[3-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-2-[3-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-(2-methyl-5-piperidinosulfonyl-phenyl)-2-[[3-(trifluoromethyl)phenyl]thio]acetamide Formula: C21H23F3N2O3S2 MolecularWeight: 472.54413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CSC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CSC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H23F3N2O3S2/c1-15-8-9-18(31(28,29)26-10-3-2-4-11-26)13-19(15)25-20(27)14-30-17-7-5-6-16(12-17)21(22,23)24/h5-9,12-13H,2-4,10-11,14H2,1H3,(H,25,27)