Vitas-M small molecule compound
methyl [(5E)-5-{4-[(5-nitropyridin-2-yl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STK152385
SMILES COC(=O)CN1C(=O)S/C(=C/c2ccc(cc2)Oc2ccc(cn2)[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 C18H13N3O7S MW 415.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O7S/c1-27-16(22)10-20-17(23)14(29-18(20)24)8-11-2-5-13(6-3-11)28-15-7-4-12(9-19-15)21(25)26/h2-9H,10H2,1H3/b14-8+InChIKey
QOVVZZQHIUFAQO-RIYZIHGNSA-NSynonyms
COC(=O)CN1C(=O)C(=CC2=CC=C(C=C2)OC3=NC=C(C=C3)(N+)(=O)(O))SC1=O
COC(=O)CN1C(=O)SC(=Cc2ccc(cc2)Oc2ccc(cn2)(N+)(=O)(O))C1=O
InChI=1SC18H13N3O7Sc12716(22)102017(23)14(2918(20)24)8112513(6311)28157412(91915)21(25)26h29H10H21H3b148+
METHYL((5E)5(4((5NITROPYRIDIN2YL)OXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
METHYL2((5E)5((4(5NITROPYRIDIN2YL)OXYPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
MFCD03715261
ZINC000009261159
ZINC09261159
ZINC9261159
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