Vitas-M small molecule compound

{(2E)-3-(4-hydroxyphenyl)-2-[(2E)-(4-nitrobenzylidene)hydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl}acetic acid

Catalog ID
STK998401
SMILES OC(=O)CC1S/C(=N/N=C/c2ccc(cc2)[N+](=O)[O-])/N(C1=O)c1ccc(cc1)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 C18H14N4O6S MW 414.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N4O6S/c23-14-7-5-12(6-8-14)21-17(26)15(9-16(24)25)29-18(21)20-19-10-11-1-3-13(4-2-11)22(27)28/h1-8,10,15,23H,9H2,(H,24,25)/b19-10+,20-18+
InChIKey
VKOHOWTVNACYHL-GQVLRKDXSA-N
Synonyms
425401-90-7
((2E)3(4hydroxyphenyl)2((2E)(4nitrobenzylidene)hydrazinylidene)4oxo13thiazolidin5yl)aceticacid
(3(4HYDROXYPHENYL)2((4NITROBENZYLIDENE)HYDRAZONO)4OXO13THIAZOLIDIN5YL)ACETICACID
2((2E)3(4HYDROXYPHENYL)2((E)(4NITROPHENYL)METHYLIDENEHYDRAZINYLIDENE)4OXO13THIAZOLIDIN5YL)ACETICACID
2((E)3(4hydroxyphenyl)2((E)(4nitrobenzylidene)hydrazono)4oxothiazolidin5yl)aceticacid
2(2((2E)3(4NITROPHENYL)12DIAZAPROP2ENYLIDENE)3(4HYDROXYPHENYL)4OXO13THIAZOLIDIN5YL)ACETICACID
425401907
C1=CC(=CC=C1C=NN=C2N(C(=O)C(S2)CC(=O)O)C3=CC=C(C=C3)O)(N+)(=O)(O)
InChI=1SC18H14N4O6Sc23147512(6814)2117(26)15(916(24)25)2918(21)201910111313(4211)22(27)28h18101523H9H2(H2425)b1910+2018+
MFCD02217078
OC(=O)CC1SC(=NN=Cc2ccc(cc2)(N+)(=O)(O))N(C1=O)c1ccc(cc1)O
ZINC000009013876
ZINC000009013877

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Available files

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