Vitas-M small molecule compound
5-amino-3-[(Z)-1-cyano-2-{4-[(2,4-dichlorobenzyl)oxy]phenyl}ethenyl]-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Catalog ID
STK756451
SMILES OCCn1nc(c(c1N)C#N)/C(=C/c1ccc(cc1)OCc1ccc(cc1Cl)Cl)/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 C22H17Cl2N5O2 MW 454.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17Cl2N5O2/c23-17-4-3-15(20(24)10-17)13-31-18-5-1-14(2-6-18)9-16(11-25)21-19(12-26)22(27)29(28-21)7-8-30/h1-6,9-10,30H,7-8,13,27H2/b16-9+InChIKey
DTSCKBLSNNYJOA-CXUHLZMHSA-NSynonyms
5amino3((Z)1cyano2(4((24dichlorobenzyl)oxy)phenyl)ethenyl)1(2hydroxyethyl)1Hpyrazole4carbonitrile
5AMINO3((Z)1CYANO2(4((24DICHLOROPHENYL)METHOXY)PHENYL)ETHENYL)1(2HYDROXYETHYL)PYRAZOLE4CARBONITRILE
5AMINO3(1CYANO2(4((24DICHLOROBENZYL)OXY)PHENYL)VINYL)1(2HYDROXYETHYL)1HPYRAZOLE4CARBONITRILE
C1=CC(=CC=C1C=C(C#N)C2=NN(C(=C2C#N)N)CCO)OCC3=C(C=C(C=C3)Cl)Cl
InChI=1SC22H17Cl2N5O2c23174315(20(24)1017)1331185114(2618)916(1125)2119(1226)22(27)29(2821)7830h1691030H781327H2b169+
MFCD01029764
OCCn1nc(c(c1N)C#N)C(=Cc1ccc(cc1)OCc1ccc(cc1Cl)Cl)C#N
ZINC000008442986
ZINC08442986
ZINC8442986
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