Vitas-M small molecule compound
(5E)-3-(4-bromo-3-chlorophenyl)-5-(2-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL378605
SMILES S=C1S/C(=C/c2ccccc2[N+](=O)[O-])/C(=O)N1c1ccc(c(c1)Cl)Br
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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 C16H8BrClN2O3S2 MW 455.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H8BrClN2O3S2/c17-11-6-5-10(8-12(11)18)19-15(21)14(25-16(19)24)7-9-3-1-2-4-13(9)20(22)23/h1-8H/b14-7+InChIKey
UMOXGJUOJBZCKN-VGOFMYFVSA-NSynonyms
(5E)3(4BROMO3CHLOROPHENYL)5((2NITROPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)3(4bromo3chlorophenyl)5(2nitrobenzylidene)2thioxo13thiazolidin4one
C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=C(C=C3)Br)Cl)(N+)(=O)(O)
InChI=1SC16H8BrClN2O3S2c17116510(812(11)18)1915(21)14(2516(19)24)79312413(9)20(22)23h18Hb147+
MFCD03614141
S=C1SC(=Cc2ccccc2(N+)(=O)(O))C(=O)N1c1ccc(c(c1)Cl)Br
ZINC000003768702
ZINC03768702
ZINC3768702
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