Vitas-M small molecule compound
{2-[(Z)-{3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-pyrazol-4-ylidene}methyl]phenoxy}acetonitrile
Catalog ID
STK375875
SMILES N#CCOc1ccccc1/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 C20H14F3N3O2 MW 385.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14F3N3O2/c1-13-17(11-14-5-2-3-8-18(14)28-10-9-24)19(27)26(25-13)16-7-4-6-15(12-16)20(21,22)23/h2-8,11-12H,10H2,1H3/b17-11-InChIKey
NFVAQDJWKCHJOS-BOPFTXTBSA-NSynonyms
(2((Z)(3methyl5oxo1(3(trifluoromethyl)phenyl)15dihydro4Hpyrazol4ylidene)methyl)phenoxy)acetonitrile
2(2((3METHYL5OXO1(3(TRIFLUOROMETHYL)PHENYL)12DIAZOLIN4YLIDENE)METHYL)PHENOXY)ETHANENITRILE
2(2((Z)(3METHYL5OXO1(3(TRIFLUOROMETHYL)PHENYL)PYRAZOL4YLIDENE)METHYL)PHENOXY)ACETONITRILE
CC1=NN(C(=O)C1=CC2=CC=CC=C2OCC#N)C3=CC=CC(=C3)C(F)(F)F
InChI=1SC20H14F3N3O2c11317(1114523818(14)2810924)19(27)26(2513)1674615(1216)20(2122)23h281112H10H21H3b1711
MFCD01157401
N#CCOc1ccccc1C=C1C(=NN(C1=O)c1cccc(c1)C(F)(F)F)C
ZINC000015938690
ZINC15938690
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