N-methyl-N-phenyl-2-[4-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanoyl]piperazin-1-yl]ethanamide

Systemtic Name: N-methyl-N-phenyl-2-[4-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanoyl]piperazin-1-yl]ethanamide Openeye Name: N-methyl-N-phenyl-2-[4-[2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]piperazin-1-yl]acetamide CAS Name: N-methyl-2-[4-[1-oxo-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethyl]-1-piperazinyl]-N-phenylacetamide IUPAC Name: N-methyl-N-phenyl-2-[4-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]piperazin-1-yl]acetamide Traditional Name: N-methyl-N-phenyl-2-[4-[2-[[5-(trifluoromethyl)-2-pyridyl]thio]acetyl]piperazino]acetamide Formula: C21H23F3N4O2S MolecularWeight: 452.49313

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CN2CCN(CC2)C(=O)CSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CN2CCN(CC2)C(=O)CSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H23F3N4O2S/c1-26(17-5-3-2-4-6-17)19(29)14-27-9-11-28(12-10-27)20(30)15-31-18-8-7-16(13-25-18)21(22,23)24/h2-8,13H,9-12,14-15H2,1H3