Vitas-M small molecule compound
(5Z)-5-[(2E)-(6-bromo-4-phenylquinazolin-2(3H)-ylidene)hydrazinylidene]-6,6,6-trifluoro-2,2-dimethylhexan-3-one
Catalog ID
STL148230
SMILES Brc1ccc2c(c1)c([nH]/c(=N\N=C(/C(F)(F)F)\CC(=O)C(C)(C)C)/n2)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 C22H20BrF3N4O MW 493.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrF3N4O/c1-21(2,3)18(31)12-17(22(24,25)26)29-30-20-27-16-10-9-14(23)11-15(16)19(28-20)13-7-5-4-6-8-13/h4-11H,12H2,1-3H3,(H,27,28,30)/b29-17-InChIKey
NNLPMBKCTRAWNI-RHANQZHGSA-NSynonyms
(5Z)5((2E)(6bromo4phenylquinazolin2(3H)ylidene)hydrazinylidene)666trifluoro22dimethylhexan3one
(5Z)5((6BROMO4PHENYLQUINAZOLIN2YL)HYDRAZINYLIDENE)666TRIFLUORO22DIMETHYLHEXAN3ONE
111TRIFLUORO55DIMETHYL24HEXANEDIONE2((6BROMO4PHENYL2QUINAZOLINYL)HYDRAZONE)
Brc1ccc2c(c1)c((nH)c(=NN=C(C(F)(F)F)CC(=O)C(C)(C)C)n2)c1ccccc1
CC(C)(C)C(=O)CC(=NNC1=NC2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=C3)C(F)(F)F
InChI=1SC22H20BrF3N4Oc121(23)18(31)1217(22(2425)26)293020271610914(23)1115(16)19(2820)137546813h411H12H213H3(H272830)b2917
MFCD03803775
ZINC000009008291
ZINC17746371
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