Vitas-M small molecule compound
(2E)-2-cyano-3-[1-(2-ethyl-6-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-N-(3-methoxyphenyl)prop-2-enamide
Catalog ID
STK062518
SMILES COc1cccc(c1)NC(=O)/C(=C/c1cc(n(c1C)c1c(C)cccc1CC)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 C26H27N3O2 MW 413.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O2/c1-6-20-10-7-9-17(2)25(20)29-18(3)13-21(19(29)4)14-22(16-27)26(30)28-23-11-8-12-24(15-23)31-5/h7-15H,6H2,1-5H3,(H,28,30)/b22-14+InChIKey
PQRJFJQAXMQSMY-HYARGMPZSA-NSynonyms
(2E)2CYANO3(1(2ETHYL6METHYLPHENYL)25DIMETHYL1HPYRROL3YL)N(3METHOXYPHENYL)PROP2ENAMIDE
(E)2CYANO3(1(2ETHYL6METHYLPHENYL)25DIMETHYLPYRROL3YL)N(3METHOXYPHENYL)PROP2ENAMIDE
CCC1=CC=CC(=C1N2C(=CC(=C2C)C=C(C#N)C(=O)NC3=CC(=CC=C3)OC)C)C
COc1cccc(c1)NC(=O)C(=Cc1cc(n(c1C)c1c(C)cccc1CC)C)C#N
InChI=1SC26H27N3O2c1620107917(2)25(20)2918(3)1321(19(29)4)1422(1627)26(30)28231181224(1523)315h715H6H215H3(H2830)b2214+
MFCD03060419
STK062518
ZINC000005611035
ZINC05611035
ZINC5611035
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