Vitas-M small molecule compound
(2E)-2-cyano-3-(1-{4-[(2-fluorobenzyl)oxy]phenyl}-2,5-dimethyl-1H-pyrrol-3-yl)-N-(4-methylphenyl)prop-2-enamide
Catalog ID
STK183562
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)OCc1ccccc1F)C)/C(=O)Nc1ccc(cc1)C
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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 C30H26FN3O2 MW 479.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26FN3O2/c1-20-8-10-26(11-9-20)33-30(35)25(18-32)17-24-16-21(2)34(22(24)3)27-12-14-28(15-13-27)36-19-23-6-4-5-7-29(23)31/h4-17H,19H2,1-3H3,(H,33,35)/b25-17+InChIKey
RLADPOFLKPVOCX-KOEQRZSOSA-NSynonyms
(2E)2CYANO3(1(4((2FLUOROBENZYL)OXY)PHENYL)25DIMETHYL1HPYRROL3YL)N(4METHYLPHENYL)PROP2ENAMIDE
(E)2CYANO3(1(4((2FLUOROPHENYL)METHOXY)PHENYL)25DIMETHYLPYRROL3YL)N(4METHYLPHENYL)PROP2ENAMIDE
CC1=CC=C(C=C1)NC(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)OCC4=CC=CC=C4F)C)C#N
InChI=1SC30H26FN3O2c12081026(11920)3330(35)25(1832)17241621(2)34(22(24)3)27121428(151327)361923645729(23)31h417H19H213H3(H3335)b2517+
MFCD04575666
N#CC(=Cc1cc(n(c1C)c1ccc(cc1)OCc1ccccc1F)C)C(=O)Nc1ccc(cc1)C
ZINC000009261716
ZINC09261716
ZINC9261716
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