Vitas-M small molecule compound
(2E)-N-benzyl-3-[1-(4-bromo-2-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyanoprop-2-enamide
Catalog ID
STK183599
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(cc1F)Br)C)/C(=O)NCc1ccccc1
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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 C23H19BrFN3O MW 452.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrFN3O/c1-15-10-18(16(2)28(15)22-9-8-20(24)12-21(22)25)11-19(13-26)23(29)27-14-17-6-4-3-5-7-17/h3-12H,14H2,1-2H3,(H,27,29)/b19-11+InChIKey
GDXGLUXDPCNSKE-YBFXNURJSA-NSynonyms
(2E)NBENZYL3(1(4BROMO2FLUOROPHENYL)25DIMETHYL1HPYRROL3YL)2CYANOPROP2ENAMIDE
(E)NBENZYL3(1(4BROMO2FLUOROPHENYL)25DIMETHYLPYRROL3YL)2CYANOPROP2ENAMIDE
CC1=CC(=C(N1C2=C(C=C(C=C2)Br)F)C)C=C(C#N)C(=O)NCC3=CC=CC=C3
InChI=1SC23H19BrFN3Oc1151018(16(2)28(15)229820(24)1221(22)25)1119(1326)23(29)2714176435717h312H14H212H3(H2729)b1911+
MFCD04308421
N#CC(=Cc1cc(n(c1C)c1ccc(cc1F)Br)C)C(=O)NCc1ccccc1
ZINC000001096855
ZINC01096855
ZINC1096855
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