N-(1-methylsulfonylpiperidin-4-yl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(1-methylsulfonylpiperidin-4-yl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Openeye Name: N-(1-methylsulfonyl-4-piperidyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide CAS Name: N-(1-methylsulfonyl-4-piperidinyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(1-methylsulfonylpiperidin-4-yl)-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxamide Traditional Name: N-(1-mesyl-4-piperidyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Formula: C18H25F3N4O5S2 MolecularWeight: 498.54011

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H25F3N4O5S2/c1-31(27,28)24-7-5-15(6-8-24)22-17(26)23-9-11-25(12-10-23)32(29,30)16-4-2-3-14(13-16)18(19,20)21/h2-4,13,15H,5-12H2,1H3,(H,22,26)