2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-[[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]propanamide CAS Name: 2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]-N-[3-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[[5-(4-methylpiperazino)sulfonyl-2-pyridyl]thio]-N-[3-(trifluoromethyl)phenyl]propionamide Formula: C20H23F3N4O3S2 MolecularWeight: 488.54683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)SC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)SC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C20H23F3N4O3S2/c1-14(19(28)25-16-5-3-4-15(12-16)20(21,22)23)31-18-7-6-17(13-24-18)32(29,30)27-10-8-26(2)9-11-27/h3-7,12-14H,8-11H2,1-2H3,(H,25,28)