Vitas-M small molecule compound

(2E)-3-[1-(biphenyl-4-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N-(4-fluorophenyl)prop-2-enamide

Catalog ID
STK182478
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)c1ccccc1)C)/C(=O)Nc1ccc(cc1)F

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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 C28H22FN3O MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22FN3O/c1-19-16-23(17-24(18-30)28(33)31-26-12-10-25(29)11-13-26)20(2)32(19)27-14-8-22(9-15-27)21-6-4-3-5-7-21/h3-17H,1-2H3,(H,31,33)/b24-17+
InChIKey
KGMJUQUUPYIKMC-JJIBRWJFSA-N
Synonyms

(2E)3(1(BIPHENYL4YL)25DIMETHYL1HPYRROL3YL)2CYANON(4FLUOROPHENYL)PROP2ENAMIDE
(2E)3(25DIMETHYL1(4PHENYLPHENYL)PYRROL3YL)2CYANON(4FLUOROPHENYL)PROP2ENAMIDE
(E)2CYANO3(25DIMETHYL1(4PHENYLPHENYL)PYRROL3YL)N(4FLUOROPHENYL)PROP2ENAMIDE
CC1=CC(=C(N1C2=CC=C(C=C2)C3=CC=CC=C3)C)C=C(C#N)C(=O)NC4=CC=C(C=C4)F
InChI=1SC28H22FN3Oc1191623(1724(1830)28(33)3126121025(29)111326)20(2)32(19)2714822(91527)216435721h317H12H3(H3133)b2417+
MFCD02194064
N#CC(=Cc1cc(n(c1C)c1ccc(cc1)c1ccccc1)C)C(=O)Nc1ccc(cc1)F
ZINC000001189352
ZINC01189352
ZINC1189352

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Available files

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