2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-N-[2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-N-[2-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-[4-(2-thienylsulfonyl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]propanamide CAS Name: 2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-N-[2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-N-[2-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[4-(2-thienylsulfonyl)piperazino]-N-[2-(trifluoromethyl)phenyl]propionamide Formula: C18H20F3N3O3S2 MolecularWeight: 447.49491

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(F)(F)F)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(F)(F)F)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H20F3N3O3S2/c1-13(17(25)22-15-6-3-2-5-14(15)18(19,20)21)23-8-10-24(11-9-23)29(26,27)16-7-4-12-28-16/h2-7,12-13H,8-11H2,1H3,(H,22,25)