3-piperazin-1-ylsulfonyl-2-(thiophen-2-ylmethyl)-4-[3-(trifluoromethyl)pyridin-2-yl]benzamide

Systemtic Name: 3-piperazin-1-ylsulfonyl-2-(thiophen-2-ylmethyl)-4-[3-(trifluoromethyl)pyridin-2-yl]benzamide Openeye Name: 3-piperazin-1-ylsulfonyl-2-(2-thienylmethyl)-4-[3-(trifluoromethyl)-2-pyridyl]benzamide CAS Name: 3-(1-piperazinylsulfonyl)-2-(thiophen-2-ylmethyl)-4-[3-(trifluoromethyl)-2-pyridinyl]benzamide IUPAC Name: 3-piperazin-1-ylsulfonyl-2-(thiophen-2-ylmethyl)-4-[3-(trifluoromethyl)pyridin-2-yl]benzamide Traditional Name: 3-piperazinosulfonyl-2-(2-thenyl)-4-[3-(trifluoromethyl)-2-pyridyl]benzamide Formula: C22H21F3N4O3S2 MolecularWeight: 510.55235

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)S(=O)(=O)C2=C(C=CC(=C2CC3=CC=CS3)C(=O)N)C4=C(C=CC=N4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1)S(=O)(=O)C2=C(C=CC(=C2CC3=CC=CS3)C(=O)N)C4=C(C=CC=N4)C(F)(F)F

InChI

InChI=1S/C22H21F3N4O3S2/c23-22(24,25)18-4-1-7-28-19(18)16-6-5-15(21(26)30)17(13-14-3-2-12-33-14)20(16)34(31,32)29-10-8-27-9-11-29/h1-7,12,27H,8-11,13H2,(H2,26,30)