Vitas-M small molecule compound
(2E)-3-[1-(4-bromo-3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N-(3-methoxyphenyl)prop-2-enamide
Catalog ID
STK179106
SMILES COc1cccc(c1)NC(=O)/C(=C/c1cc(n(c1C)c1ccc(c(c1)Cl)Br)C)/C#N
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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 C23H19BrClN3O2 MW 484.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrClN3O2/c1-14-9-16(15(2)28(14)19-7-8-21(24)22(25)12-19)10-17(13-26)23(29)27-18-5-4-6-20(11-18)30-3/h4-12H,1-3H3,(H,27,29)/b17-10+InChIKey
JQBOBZMMIGTBHK-LICLKQGHSA-NSynonyms
(2E)3(1(4BROMO3CHLOROPHENYL)25DIMETHYL1HPYRROL3YL)2CYANON(3METHOXYPHENYL)PROP2ENAMIDE
(E)3(1(4BROMO3CHLOROPHENYL)25DIMETHYLPYRROL3YL)2CYANON(3METHOXYPHENYL)PROP2ENAMIDE
CC1=CC(=C(N1C2=CC(=C(C=C2)Br)Cl)C)C=C(C#N)C(=O)NC3=CC(=CC=C3)OC
COc1cccc(c1)NC(=O)C(=Cc1cc(n(c1C)c1ccc(c(c1)Cl)Br)C)C#N
InChI=1SC23H19BrClN3O2c114916(15(2)28(14)197821(24)22(25)1219)1017(1326)23(29)271854620(1118)303h412H13H3(H2729)b1710+
MFCD03923202
ZINC000001175059
ZINC01175059
ZINC1175059
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