Vitas-M small molecule compound
(5E)-5-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-2-thioxo-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
Catalog ID
STL428790
SMILES S=C1S/C(=C/c2cccn2c2ccc(cc2)[N+](=O)[O-])/C(=O)N1c1cccc(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 C21H12F3N3O3S2 MW 475.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12F3N3O3S2/c22-21(23,24)13-3-1-4-17(11-13)26-19(28)18(32-20(26)31)12-16-5-2-10-25(16)14-6-8-15(9-7-14)27(29)30/h1-12H/b18-12+InChIKey
RMJJLIRPLRAWKP-LDADJPATSA-NSynonyms
(5E)5((1(4nitrophenyl)1Hpyrrol2yl)methylidene)2thioxo3(3(trifluoromethyl)phenyl)13thiazolidin4one
(5E)5((1(4nitrophenyl)pyrrol2yl)methylidene)2sulfanylidene3(3(trifluoromethyl)phenyl)13thiazolidin4one
C1=CC(=CC(=C1)N2C(=O)C(=CC3=CC=CN3C4=CC=C(C=C4)(N+)(=O)(O))SC2=S)C(F)(F)F
InChI=1SC21H12F3N3O3S2c2221(2324)1331417(1113)2619(28)18(3220(26)31)1216521025(16)146815(9714)27(29)30h112Hb1812+
MFCD05625083
S=C1SC(=Cc2cccn2c2ccc(cc2)(N+)(=O)(O))C(=O)N1c1cccc(c1)C(F)(F)F
ZINC000009310627
ZINC09310627
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