Vitas-M small molecule compound
(2E)-N-(4-chloro-3-nitrophenyl)-2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enamide
Catalog ID
STK041311
SMILES N#C/C(=C\c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)/C(=O)Nc1ccc(c(c1)[N+](=O)[O-])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 C24H26ClN3O4 MW 455.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClN3O4/c1-23(2,3)17-10-14(11-18(21(17)29)24(4,5)6)9-15(13-26)22(30)27-16-7-8-19(25)20(12-16)28(31)32/h7-12,29H,1-6H3,(H,27,30)/b15-9+InChIKey
BNLNWAAOVMYHDQ-OQLLNIDSSA-NSynonyms
402615-64-9(2E)N(4CHLORO3NITROPHENYL)2CYANO3(35DITERTBUTYL4HYDROXYPHENYL)PROP2ENAMIDE
(E)N(4CHLORO3NITROPHENYL)2CYANO3(35DITERTBUTYL4HYDROXYPHENYL)PROP2ENAMIDE
402615649
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C(C#N)C(=O)NC2=CC(=C(C=C2)Cl)(N+)(=O)(O)
InChI=1SC24H26ClN3O4c123(23)171014(1118(21(17)29)24(45)6)915(1326)22(30)27167819(25)20(1216)28(31)32h71229H16H3(H2730)b159+
MFCD02374271
N#CC(=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C(=O)Nc1ccc(c(c1)(N+)(=O)(O))Cl
STK041311
ZINC000013942500
ZINC13942500
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