Vitas-M small molecule compound

ethyl [(5Z)-5-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Catalog ID
STK157129
SMILES CCOC(=O)CN1C(=O)S/C(=C\c2ccc(o2)c2ccc(cc2Br)[N+](=O)[O-])/C1=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 C18H13BrN2O7S MW 481.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrN2O7S/c1-2-27-16(22)9-20-17(23)15(29-18(20)24)8-11-4-6-14(28-11)12-5-3-10(21(25)26)7-13(12)19/h3-8H,2,9H2,1H3/b15-8-
InChIKey
PBMXHCPJHOYFTH-NVNXTCNLSA-N
Synonyms

CCOC(=O)CN1C(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)(N+)(=O)(O))Br)SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2ccc(o2)c2ccc(cc2Br)(N+)(=O)(O))C1=O
ETHYL((5Z)5((5(2BROMO4NITROPHENYL)FURAN2YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL(5((5(2BROMO4NITROPHENYL)2FURYL)METHYLENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL2((5Z)5((5(2BROMO4NITROPHENYL)FURAN2YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC18H13BrN2O7Sc122716(22)92017(23)15(2918(20)24)8114614(2811)125310(21(25)26)713(12)19h38H29H21H3b158
MFCD03143147
ZINC000000979859
ZINC00979859
ZINC979859

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Available files

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