Vitas-M small molecule compound
(4E)-4-({[2-chloro-5-(trifluoromethyl)phenyl]amino}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK897996
SMILES CC1=NN(C(=O)/C/1=C/Nc1cc(ccc1Cl)C(F)(F)F)c1ccccc1
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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 C18H13ClF3N3O MW 379.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClF3N3O/c1-11-14(17(26)25(24-11)13-5-3-2-4-6-13)10-23-16-9-12(18(20,21)22)7-8-15(16)19/h2-10,23H,1H3/b14-10+InChIKey
WQOGMPJGXSHBHH-GXDHUFHOSA-NSynonyms
(4E)4(((2chloro5(trifluoromethyl)phenyl)amino)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4E)4((2chloro5(trifluoromethyl)anilino)methylidene)5methyl2phenylpyrazol3one
CC1=NN(C(=O)C1=CNc1cc(ccc1Cl)C(F)(F)F)c1ccccc1
CC1=NN(C(=O)C1=CNC2=C(C=CC(=C2)C(F)(F)F)Cl)C3=CC=CC=C3
InChI=1SC18H13ClF3N3Oc11114(17(26)25(2411)135324613)102316912(18(2021)22)7815(16)19h21023H1H3b1410+
MFCD03670193
ZINC000102570099
ZINC102570099
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