Vitas-M small molecule compound
methyl 2-chloro-5-(5-{(E)-2-[5-cyano-4-(methoxymethyl)-3-nitro-6-oxo-1,6-dihydropyridin-2-yl]ethenyl}furan-2-yl)benzoate
Catalog ID
STK132565
SMILES COCc1c(C#N)c(=O)[nH]c(c1[N+](=O)[O-])/C=C/c1ccc(o1)c1ccc(c(c1)C(=O)OC)Cl
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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 C22H16ClN3O7 MW 469.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O7/c1-31-11-16-15(10-24)21(27)25-18(20(16)26(29)30)7-4-13-5-8-19(33-13)12-3-6-17(23)14(9-12)22(28)32-2/h3-9H,11H2,1-2H3,(H,25,27)/b7-4+InChIKey
WWSGKMHRYAROSI-QPJJXVBHSA-NSynonyms
COCC1=C(C(=O)NC(=C1(N+)(=O)(O))C=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)OC)C#N
COCc1c(C#N)c(=O)(nH)c(c1(N+)(=O)(O))C=Cc1ccc(o1)c1ccc(c(c1)C(=O)OC)Cl
InChI=1SC22H16ClN3O7c131111615(1024)21(27)2518(20(16)26(29)30)74135819(3313)123617(23)14(912)22(28)322h39H11H212H3(H2527)b74+
METHYL2CHLORO5(5((E)2(5CYANO4(METHOXYMETHYL)3NITRO6OXO16DIHYDROPYRIDIN2YL)ETHENYL)FURAN2YL)BENZOATE
METHYL2CHLORO5(5((E)2(5CYANO4(METHOXYMETHYL)3NITRO6OXO1HPYRIDIN2YL)ETHENYL)FURAN2YL)BENZOATE
MFCD05815923
ZINC000009234555
ZINC9234555
Check stock
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