Vitas-M small molecule compound
5-amino-3-[(Z)-1-cyano-2-{4-[(4-fluorobenzyl)oxy]-3,5-dimethoxyphenyl}ethenyl]-1-phenyl-1H-pyrazole-4-carbonitrile
Catalog ID
STK720207
SMILES N#C/C(=C\c1cc(OC)c(c(c1)OC)OCc1ccc(cc1)F)/c1nn(c(c1C#N)N)c1ccccc1
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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 C28H22FN5O3 MW 495.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22FN5O3/c1-35-24-13-19(14-25(36-2)27(24)37-17-18-8-10-21(29)11-9-18)12-20(15-30)26-23(16-31)28(32)34(33-26)22-6-4-3-5-7-22/h3-14H,17,32H2,1-2H3/b20-12+InChIKey
OAYXSGSCZLKWGH-UDWIEESQSA-NSynonyms
5amino3((Z)1cyano2(4((4fluorobenzyl)oxy)35dimethoxyphenyl)ethenyl)1phenyl1Hpyrazole4carbonitrile
5AMINO3((Z)1CYANO2(4((4FLUOROPHENYL)METHOXY)35DIMETHOXYPHENYL)ETHENYL)1PHENYLPYRAZOLE4CARBONITRILE
COC1=CC(=CC(=C1OCC2=CC=C(C=C2)F)OC)C=C(C#N)C3=NN(C(=C3C#N)N)C4=CC=CC=C4
InChI=1SC28H22FN5O3c135241319(1425(362)27(24)37171881021(29)11918)1220(1530)2623(1631)28(32)34(3326)226435722h314H1732H212H3b2012+
MFCD03763609
N#CC(=Cc1cc(OC)c(c(c1)OC)OCc1ccc(cc1)F)c1nn(c(c1C#N)N)c1ccccc1
ZINC000012418891
ZINC12418891
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