Vitas-M small molecule compound
5-amino-3-[(Z)-1-cyano-2-{2-[(2,4-dichlorobenzyl)oxy]-3-methoxyphenyl}ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Catalog ID
STK756390
SMILES OCCn1nc(c(c1N)C#N)/C(=C/c1cccc(c1OCc1ccc(cc1Cl)Cl)OC)/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 C23H19Cl2N5O3 MW 484.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19Cl2N5O3/c1-32-20-4-2-3-14(22(20)33-13-15-5-6-17(24)10-19(15)25)9-16(11-26)21-18(12-27)23(28)30(29-21)7-8-31/h2-6,9-10,31H,7-8,13,28H2,1H3/b16-9+InChIKey
FYXGKTGEXYDSAX-CXUHLZMHSA-NSynonyms
5amino3((Z)1cyano2(2((24dichlorobenzyl)oxy)3methoxyphenyl)ethenyl)1(2hydroxyethyl)1Hpyrazole4carbonitrile
5AMINO3((Z)1CYANO2(2((24DICHLOROPHENYL)METHOXY)3METHOXYPHENYL)ETHENYL)1(2HYDROXYETHYL)PYRAZOLE4CARBONITRILE
COC1=CC=CC(=C1OCC2=C(C=C(C=C2)Cl)Cl)C=C(C#N)C3=NN(C(=C3C#N)N)CCO
InChI=1SC23H19Cl2N5O3c1322042314(22(20)3313155617(24)1019(15)25)916(1126)2118(1227)23(28)30(2921)7831h2691031H781328H21H3b169+
MFCD01066280
OCCn1nc(c(c1N)C#N)C(=Cc1cccc(c1OCc1ccc(cc1Cl)Cl)OC)C#N
ZINC000008407002
ZINC08407002
ZINC8407002
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