Vitas-M small molecule compound
(2E)-3-(3-{4-[(4-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-(2-ethylhexyl)prop-2-enamide
Catalog ID
STK810448
SMILES CCCCC(CNC(=O)/C(=C/c1cn(nc1c1ccc(cc1)OCc1ccc(cc1)Cl)c1ccccc1)/C#N)CC
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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 C34H35ClN4O2 MW 567.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H35ClN4O2/c1-3-5-9-25(4-2)22-37-34(40)28(21-36)20-29-23-39(31-10-7-6-8-11-31)38-33(29)27-14-18-32(19-15-27)41-24-26-12-16-30(35)17-13-26/h6-8,10-20,23,25H,3-5,9,22,24H2,1-2H3,(H,37,40)/b28-20+InChIKey
SCLJTPCEDWJYJX-VFCFBJKWSA-NSynonyms
(2E)3(3(4((4chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2cyanoN(2ethylhexyl)prop2enamide
(E)3(3(4((4CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)2CYANON(2ETHYLHEXYL)PROP2ENAMIDE
CCCCC(CC)CNC(=O)C(=CC1=CN(N=C1C2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl)C4=CC=CC=C4)C#N
CCCCC(CNC(=O)C(=Cc1cn(nc1c1ccc(cc1)OCc1ccc(cc1)Cl)c1ccccc1)C#N)CC
InChI=1SC34H35ClN4O2c135925(42)223734(40)28(2136)20292339(31107681131)3833(29)27141832(191527)412426121630(35)171326h6810202325H3592224H212H3(H3740)b2820+
MFCD04556782
ZINC000097946311
ZINC000097946312
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