Vitas-M small molecule compound
(2E)-3-(3-{4-[(2,4-dichlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile
Catalog ID
STK812451
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccc(cc1Cl)Cl)c1ccccc1)/C(=O)N1CCOCC1
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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 C30H24Cl2N4O3 MW 559.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24Cl2N4O3/c31-25-9-6-22(28(32)17-25)20-39-27-10-7-21(8-11-27)29-24(19-36(34-29)26-4-2-1-3-5-26)16-23(18-33)30(37)35-12-14-38-15-13-35/h1-11,16-17,19H,12-15,20H2/b23-16+InChIKey
ZBTAWOPXEXQLEN-XQNSMLJCSA-NSynonyms
(2E)3(3(4((24dichlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2(morpholin4ylcarbonyl)prop2enenitrile
(E)3(3(4((24DICHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)2(MORPHOLINE4CARBONYL)PROP2ENENITRILE
C1COCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=C(C=C(C=C4)Cl)Cl)C5=CC=CC=C5)C#N
InChI=1SC30H24Cl2N4O3c31259622(28(32)1725)20392710721(81127)2924(1936(3429)264213526)1623(1833)30(37)35121438151335h111161719H121520H2b2316+
MFCD06265001
N#CC(=Cc1cn(nc1c1ccc(cc1)OCc1ccc(cc1Cl)Cl)c1ccccc1)C(=O)N1CCOCC1
ZINC000097946478
ZINC97946478
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