Vitas-M small molecule compound
5-amino-3-[(Z)-1-cyano-2-{4-[(4-fluorobenzyl)oxy]-3,5-dimethoxyphenyl}ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Catalog ID
STK769758
SMILES OCCn1nc(c(c1N)C#N)/C(=C/c1cc(OC)c(c(c1)OC)OCc1ccc(cc1)F)/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 C24H22FN5O4 MW 463.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN5O4/c1-32-20-10-16(9-17(12-26)22-19(13-27)24(28)30(29-22)7-8-31)11-21(33-2)23(20)34-14-15-3-5-18(25)6-4-15/h3-6,9-11,31H,7-8,14,28H2,1-2H3/b17-9+InChIKey
VBAMRLOQHYBMEJ-RQZCQDPDSA-NSynonyms
5amino3((Z)1cyano2(4((4fluorobenzyl)oxy)35dimethoxyphenyl)ethenyl)1(2hydroxyethyl)1Hpyrazole4carbonitrile
5AMINO3((Z)1CYANO2(4((4FLUOROPHENYL)METHOXY)35DIMETHOXYPHENYL)ETHENYL)1(2HYDROXYETHYL)PYRAZOLE4CARBONITRILE
COC1=CC(=CC(=C1OCC2=CC=C(C=C2)F)OC)C=C(C#N)C3=NN(C(=C3C#N)N)CCO
InChI=1SC24H22FN5O4c132201016(917(1226)2219(1327)24(28)30(2922)7831)1121(332)23(20)3414153518(25)6415h3691131H781428H212H3b179+
MFCD03763624
OCCn1nc(c(c1N)C#N)C(=Cc1cc(OC)c(c(c1)OC)OCc1ccc(cc1)F)C#N
ZINC000008868202
ZINC08868202
ZINC8868202
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