Vitas-M small molecule compound

methyl 3-{5-[(Z)-{3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-pyrazol-4-ylidene}methyl]furan-2-yl}benzoate

Catalog ID
STL330508
SMILES COC(=O)c1cccc(c1)c1ccc(o1)/C=C\1/C(=NN(C1=O)c1cccc(c1)C(F)(F)F)C

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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 C24H17F3N2O4 MW 454.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17F3N2O4/c1-14-20(22(30)29(28-14)18-8-4-7-17(12-18)24(25,26)27)13-19-9-10-21(33-19)15-5-3-6-16(11-15)23(31)32-2/h3-13H,1-2H3/b20-13-
InChIKey
QCLQWQSSTRCQOA-MOSHPQCFSA-N
Synonyms

(Z)methyl3(5((3methyl5oxo1(3(trifluoromethyl)phenyl)1Hpyrazol4(5H)ylidene)methyl)furan2yl)benzoate
CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=CC(=CC=C3)C(=O)OC)C4=CC=CC(=C4)C(F)(F)F
COC(=O)c1cccc(c1)c1ccc(o1)C=C1C(=NN(C1=O)c1cccc(c1)C(F)(F)F)C
InChI=1SC24H17F3N2O4c11420(22(30)29(2814)1884717(1218)24(2526)27)131991021(3319)1553616(1115)23(31)322h313H12H3b2013
methyl3(5((Z)(3methyl5oxo1(3(trifluoromethyl)phenyl)15dihydro4Hpyrazol4ylidene)methyl)furan2yl)benzoate
METHYL3(5((Z)(3METHYL5OXO1(3(TRIFLUOROMETHYL)PHENYL)PYRAZOL4YLIDENE)METHYL)FURAN2YL)BENZOATE
MFCD02614715
ZINC000009357837
ZINC09357837
ZINC9357837

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Available files

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