Vitas-M small molecule compound
4-(2,5-dioxo-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrrolidin-1-yl)benzoic acid
Catalog ID
STK018381
SMILES O=C1CC(C(=O)N1c1ccc(cc1)C(=O)O)N1CCN(CC1)c1cccc(c1)C(F)(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H20F3N3O4 MW 447.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F3N3O4/c23-22(24,25)15-2-1-3-17(12-15)26-8-10-27(11-9-26)18-13-19(29)28(20(18)30)16-6-4-14(5-7-16)21(31)32/h1-7,12,18H,8-11,13H2,(H,31,32)InChIKey
AWDFOJFFZDKVDA-UHFFFAOYSA-NSynonyms
313705-20-34(25DIOXO3(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1IUM1YL)PYRROLIDIN1YL)BENZOATE
4(25DIOXO3(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PYRROLIDIN1YL)BENZOICACID
4(25DIOXO3(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)AZOLIDINYL)BENZOICACID
C1CN(CCN1C2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)O)C4=CC=CC(=C4)C(F)(F)F
InChI=1SC22H20F3N3O4c2322(2425)1521317(1215)2681027(11926)181319(29)28(20(18)30)166414(5716)21(31)32h171218H81113H2(H3132)
O=C1CC(C(=O)N1c1ccc(cc1)C(=O)O)N1CCN(CC1)c1cccc(c1)C(F)(F)F
STK018381
ZINC000000821728
ZINC000018276676
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