Vitas-M small molecule compound
propyl 4-[(4Z)-4-[4-(benzyloxy)-3-methoxybenzylidene]-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Catalog ID
STL431795
SMILES CCCOC(=O)c1ccc(cc1)N1N=C(/C(=C/c2ccc(c(c2)OC)OCc2ccccc2)/C1=O)C(F)(F)F
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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 C29H25F3N2O5 MW 538.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25F3N2O5/c1-3-15-38-28(36)21-10-12-22(13-11-21)34-27(35)23(26(33-34)29(30,31)32)16-20-9-14-24(25(17-20)37-2)39-18-19-7-5-4-6-8-19/h4-14,16-17H,3,15,18H2,1-2H3/b23-16-InChIKey
IZYJPLUCNTVHMC-KQWNVCNZSA-NSynonyms
CCCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=N2)C(F)(F)F
CCCOC(=O)c1ccc(cc1)N1N=C(C(=Cc2ccc(c(c2)OC)OCc2ccccc2)C1=O)C(F)(F)F
InChI=1SC29H25F3N2O5c13153828(36)21101222(131121)3427(35)23(26(3334)29(3031)32)162091424(25(1720)372)3918197546819h4141617H31518H212H3b2316
MFCD04225379
PROPYL4((4Z)4((3METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)5OXO3(TRIFLUOROMETHYL)PYRAZOL1YL)BENZOATE
propyl4((4Z)4(4(benzyloxy)3methoxybenzylidene)5oxo3(trifluoromethyl)45dihydro1Hpyrazol1yl)benzoate
ZINC000100164571
ZINC100164571
Check stock
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