Vitas-M small molecule compound
(5Z)-5-[3-fluoro-4-(pyrrolidin-1-yl)benzylidene]-3-(3-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK155088
SMILES O=C1S/C(=C\c2ccc(c(c2)F)N2CCCC2)/C(=O)N1Cc1cccc(c1)[N+](=O)[O-]
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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 C21H18FN3O4S MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O4S/c22-17-11-14(6-7-18(17)23-8-1-2-9-23)12-19-20(26)24(21(27)30-19)13-15-4-3-5-16(10-15)25(28)29/h3-7,10-12H,1-2,8-9,13H2/b19-12-InChIKey
GFQPHUXZXBOLCE-UNOMPAQXSA-NSynonyms
(5Z)5((3FLUORO4PYRROLIDIN1YLPHENYL)METHYLIDENE)3((3NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
(5Z)5(3FLUORO4(PYRROLIDIN1YL)BENZYLIDENE)3(3NITROBENZYL)13THIAZOLIDINE24DIONE
C1CCN(C1)C2=C(C=C(C=C2)C=C3C(=O)N(C(=O)S3)CC4=CC(=CC=C4)(N+)(=O)(O))F
InChI=1SC21H18FN3O4Sc22171114(6718(17)23812923)121920(26)24(21(27)3019)131543516(1015)25(28)29h371012H128913H2b1912
MFCD03994218
O=C1SC(=Cc2ccc(c(c2)F)N2CCCC2)C(=O)N1Cc1cccc(c1)(N+)(=O)(O)
ZINC000001131843
ZINC01131843
ZINC1131843
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