Vitas-M small molecule compound
(2E)-2-cyano-3-(1-{4-[(4-cyanobenzyl)oxy]phenyl}-2,5-dimethyl-1H-pyrrol-3-yl)-N-cyclohexylprop-2-enamide
Catalog ID
STK035758
SMILES N#Cc1ccc(cc1)COc1ccc(cc1)n1c(C)cc(c1C)/C=C(/C(=O)NC1CCCCC1)\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 C30H30N4O2 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N4O2/c1-21-16-25(17-26(19-32)30(35)33-27-6-4-3-5-7-27)22(2)34(21)28-12-14-29(15-13-28)36-20-24-10-8-23(18-31)9-11-24/h8-17,27H,3-7,20H2,1-2H3,(H,33,35)/b26-17+InChIKey
RTECQPRKORWTEX-YZSQISJMSA-NSynonyms
(2E)2CYANO3(1(4((4CYANOBENZYL)OXY)PHENYL)25DIMETHYL1HPYRROL3YL)NCYCLOHEXYLPROP2ENAMIDE
(E)2CYANO3(1(4((4CYANOPHENYL)METHOXY)PHENYL)25DIMETHYLPYRROL3YL)NCYCLOHEXYLPROP2ENAMIDE
CC1=CC(=C(N1C2=CC=C(C=C2)OCC3=CC=C(C=C3)C#N)C)C=C(C#N)C(=O)NC4CCCCC4
InChI=1SC30H30N4O2c1211625(1726(1932)30(35)33276435727)22(2)34(21)28121429(151328)36202410823(1831)91124h81727H3720H212H3(H3335)b2617+
MFCD03242108
N#Cc1ccc(cc1)COc1ccc(cc1)n1c(C)cc(c1C)C=C(C(=O)NC1CCCCC1)C#N
STK035758
ZINC000009246296
ZINC09246296
ZINC9246296
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