Vitas-M small molecule compound
(2Z)-3-[3-bromo-5-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]-2-(4-nitrophenyl)prop-2-enenitrile
Catalog ID
STK698226
SMILES COc1cc(/C=C(/c2ccc(cc2)[N+](=O)[O-])\C#N)cc(c1OCc1cccc2c1cccc2)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 C27H19BrN2O4 MW 515.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19BrN2O4/c1-33-26-15-18(13-22(16-29)19-9-11-23(12-10-19)30(31)32)14-25(28)27(26)34-17-21-7-4-6-20-5-2-3-8-24(20)21/h2-15H,17H2,1H3/b22-13+InChIKey
MNCUOSJLCNWEKE-LPYMAVHISA-NSynonyms
(2Z)3(3bromo5methoxy4(naphthalen1ylmethoxy)phenyl)2(4nitrophenyl)prop2enenitrile
(E)3(3bromo5methoxy4(naphthalen1ylmethoxy)phenyl)2(4nitrophenyl)acrylonitrile
(Z)3(3BROMO5METHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)2(4NITROPHENYL)PROP2ENENITRILE
COC1=C(C(=CC(=C1)C=C(C#N)C2=CC=C(C=C2)(N+)(=O)(O))Br)OCC3=CC=CC4=CC=CC=C43
COc1cc(C=C(c2ccc(cc2)(N+)(=O)(O))C#N)cc(c1OCc1cccc2c1cccc2)Br
InChI=1SC27H19BrN2O4c133261518(1322(1629)1991123(121019)30(31)32)1425(28)27(26)34172174620523824(20)21h215H17H21H3b2213+
MFCD05975601
ZINC000001836642
ZINC01836642
ZINC1836642
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