Vitas-M small molecule compound
(2E)-2-cyano-3-(1-{4-[(4-fluorobenzyl)oxy]phenyl}-2,5-dimethyl-1H-pyrrol-3-yl)-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK179186
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)OCc1ccc(cc1)F)C)/C(=O)NCC1CCCO1
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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 C28H28FN3O3 MW 473.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28FN3O3/c1-19-14-22(15-23(16-30)28(33)31-17-27-4-3-13-34-27)20(2)32(19)25-9-11-26(12-10-25)35-18-21-5-7-24(29)8-6-21/h5-12,14-15,27H,3-4,13,17-18H2,1-2H3,(H,31,33)/b23-15+InChIKey
KEAQAGUFMOBJRR-HZHRSRAPSA-NSynonyms
(2E)2CYANO3(1(4((4FLUOROBENZYL)OXY)PHENYL)25DIMETHYL1HPYRROL3YL)N(TETRAHYDROFURAN2YLMETHYL)PROP2ENAMIDE
(E)2CYANO3(1(4((4FLUOROPHENYL)METHOXY)PHENYL)25DIMETHYLPYRROL3YL)N(OXOLAN2YLMETHYL)PROP2ENAMIDE
CC1=CC(=C(N1C2=CC=C(C=C2)OCC3=CC=C(C=C3)F)C)C=C(C#N)C(=O)NCC4CCCO4
InChI=1SC28H28FN3O3c1191422(1523(1630)28(33)31172743133427)20(2)32(19)2591126(121025)3518215724(29)8621h512141527H34131718H212H3(H3133)b2315+
MFCD04372371
N#CC(=Cc1cc(n(c1C)c1ccc(cc1)OCc1ccc(cc1)F)C)C(=O)NCC1CCCO1
ZINC000001410488
ZINC000001410490
Check stock
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