Vitas-M small molecule compound
(2E)-N-(2-chloro-5-nitrophenyl)-2-cyano-3-{4-methoxy-3-[(naphthalen-2-yloxy)methyl]phenyl}prop-2-enamide
Catalog ID
STK472883
SMILES N#C/C(=C\c1ccc(c(c1)COc1ccc2c(c1)cccc2)OC)/C(=O)Nc1cc(ccc1Cl)[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 C28H20ClN3O5 MW 513.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20ClN3O5/c1-36-27-11-6-18(13-22(27)17-37-24-9-7-19-4-2-3-5-20(19)14-24)12-21(16-30)28(33)31-26-15-23(32(34)35)8-10-25(26)29/h2-15H,17H2,1H3,(H,31,33)/b21-12+InChIKey
QWLYKXWWDZCDOH-CIAFOILYSA-NSynonyms
(2E)N(2chloro5nitrophenyl)2cyano3(4methoxy3((naphthalen2yloxy)methyl)phenyl)prop2enamide
(2E)N(2CHLORO5NITROPHENYL)2CYANO3(4METHOXY3(2NAPHTHYLOXYMETHYL)PHENYL)PROP2ENAMIDE
(E)N(2chloro5nitrophenyl)2cyano3(4methoxy3(naphthalen2yloxymethyl)phenyl)prop2enamide
COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=C(C=CC(=C2)(N+)(=O)(O))Cl)COC3=CC4=CC=CC=C4C=C3
InChI=1SC28H20ClN3O5c1362711618(1322(27)1737249719423520(19)1424)1221(1630)28(33)31261523(32(34)35)81025(26)29h215H17H21H3(H3133)b2112+
MFCD07091938
N#CC(=Cc1ccc(c(c1)COc1ccc2c(c1)cccc2)OC)C(=O)Nc1cc(ccc1Cl)(N+)(=O)(O)
ZINC000020258620
ZINC20258620
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