Vitas-M small molecule compound
2-methyl-4-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carbonitrile
Catalog ID
STK771785
SMILES N#CC1=C(C)NC(=O)C1(c1c(C)[nH]n(c1=O)c1ccccc1)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 C17H13F3N4O2 MW 362.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13F3N4O2/c1-9-12(8-21)16(15(26)22-9,17(18,19)20)13-10(2)23-24(14(13)25)11-6-4-3-5-7-11/h3-7,23H,1-2H3,(H,22,26)InChIKey
BEMMJIXHNXESAY-UHFFFAOYSA-NSynonyms
587009-44-72METHYL4(5METHYL3OXO2PHENYL1HPYRAZOL4YL)5OXO4(TRIFLUOROMETHYL)1HPYRROLE3CARBONITRILE
2methyl4(5methyl3oxo2phenyl23dihydro1Hpyrazol4yl)5oxo4(trifluoromethyl)45dihydro1Hpyrrole3carbonitrile
587009447
CC1=C(C(C(=O)N1)(C2=C(NN(C2=O)C3=CC=CC=C3)C)C(F)(F)F)C#N
InChI=1SC17H13F3N4O2c1912(821)16(15(26)22917(1819)20)1310(2)2324(14(13)25)116435711h3723H12H3(H2226)
MFCD03767615
N#CC1=C(C)NC(=O)C1(c1c(C)(nH)n(c1=O)c1ccccc1)C(F)(F)F
ZINC000100137340
ZINC000100137345
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