Vitas-M small molecule compound
(5E)-5-[3-bromo-4-(dimethylamino)benzylidene]-3-(4-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL419359
SMILES S=C1S/C(=C/c2ccc(c(c2)Br)N(C)C)/C(=O)N1c1ccc(cc1)[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 C18H14BrN3O3S2 MW 464.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14BrN3O3S2/c1-20(2)15-8-3-11(9-14(15)19)10-16-17(23)21(18(26)27-16)12-4-6-13(7-5-12)22(24)25/h3-10H,1-2H3/b16-10+InChIKey
JJHWLOLPMHLNSZ-MHWRWJLKSA-NSynonyms
(5E)5((3bromo4(dimethylamino)phenyl)methylidene)3(4nitrophenyl)2sulfanylidene13thiazolidin4one
(5E)5(3bromo4(dimethylamino)benzylidene)3(4nitrophenyl)2thioxo13thiazolidin4one
CN(C)C1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC=C(C=C3)(N+)(=O)(O))Br
InChI=1SC18H14BrN3O3S2c120(2)158311(914(15)19)101617(23)21(18(26)2716)124613(7512)22(24)25h310H12H3b1610+
MFCD01591168
S=C1SC(=Cc2ccc(c(c2)Br)N(C)C)C(=O)N1c1ccc(cc1)(N+)(=O)(O)
ZINC000009310705
ZINC09310705
ZINC9310705
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