Vitas-M small molecule compound
(5Z)-3-benzyl-5-(3-bromo-2-hydroxy-5-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL427878
SMILES S=C1S/C(=C\c2cc(cc(c2O)Br)[N+](=O)[O-])/C(=O)N1Cc1ccccc1
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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 C17H11BrN2O4S2 MW 451.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11BrN2O4S2/c18-13-8-12(20(23)24)6-11(15(13)21)7-14-16(22)19(17(25)26-14)9-10-4-2-1-3-5-10/h1-8,21H,9H2/b14-7-InChIKey
QJEDCWHSEASSRX-AUWJEWJLSA-NSynonyms
(5Z)3BENZYL5((3BROMO2HYDROXY5NITROPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3benzyl5(3bromo2hydroxy5nitrobenzylidene)2thioxo13thiazolidin4one
C1=CC=C(C=C1)CN2C(=O)C(=CC3=CC(=CC(=C3O)Br)(N+)(=O)(O))SC2=S
InChI=1SC17H11BrN2O4S2c1813812(20(23)24)611(15(13)21)71416(22)19(17(25)2614)9104213510h1821H9H2b147
MFCD01151273
S=C1SC(=Cc2cc(cc(c2O)Br)(N+)(=O)(O))C(=O)N1Cc1ccccc1
ZINC000016479694
ZINC16479694
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