Vitas-M small molecule compound
(2E)-3-{3-bromo-5-ethoxy-4-[(3-nitrobenzyl)oxy]phenyl}-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Catalog ID
STK364667
SMILES CCOc1cc(/C=C(/C(=O)NCCc2c[nH]c3c2cccc3)\C#N)cc(c1OCc1cccc(c1)[N+](=O)[O-])Br
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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 C29H25BrN4O5 MW 589.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25BrN4O5/c1-2-38-27-15-20(14-25(30)28(27)39-18-19-6-5-7-23(13-19)34(36)37)12-22(16-31)29(35)32-11-10-21-17-33-26-9-4-3-8-24(21)26/h3-9,12-15,17,33H,2,10-11,18H2,1H3,(H,32,35)/b22-12+InChIKey
OOFJPYMKYKSVIM-WSDLNYQXSA-NSynonyms
(2E)3(3BROMO5ETHOXY4((3NITROBENZYL)OXY)PHENYL)2CYANON(2(1HINDOL3YL)ETHYL)PROP2ENAMIDE
(2E)3(3BROMO5ETHOXY4((3NITROPHENYL)METHOXY)PHENYL)2CYANON(2INDOL3YLETHYL)PROP2ENAMIDE
(E)3(3BROMO5ETHOXY4((3NITROPHENYL)METHOXY)PHENYL)2CYANON(2(1HINDOL3YL)ETHYL)PROP2ENAMIDE
CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)NCCC2=CNC3=CC=CC=C32)Br)OCC4=CC(=CC=C4)(N+)(=O)(O)
CCOc1cc(C=C(C(=O)NCCc2c(nH)c3c2cccc3)C#N)cc(c1OCc1cccc(c1)(N+)(=O)(O))Br
InChI=1SC29H25BrN4O5c1238271520(1425(30)28(27)39181965723(1319)34(36)37)1222(1631)29(35)32111021173326943824(21)26h3912151733H2101118H21H3(H3235)b2212+
MFCD04966502
ZINC000100223141
ZINC100223141
Check stock
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