Vitas-M small molecule compound
(3Z)-4,4,4-trifluoro-1-(4-methylphenyl)-3-{2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]hydrazinylidene}butan-1-one
Catalog ID
STL438221
SMILES Cc1ccc(cc1)C(=O)C/C(=N/Nc1scc(n1)c1cccc(c1)[N+](=O)[O-])/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 C20H15F3N4O3S MW 448.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N4O3S/c1-12-5-7-13(8-6-12)17(28)10-18(20(21,22)23)25-26-19-24-16(11-31-19)14-3-2-4-15(9-14)27(29)30/h2-9,11H,10H2,1H3,(H,24,26)/b25-18-InChIKey
PKLZNQISYWIZIV-BWAHOGKJSA-NSynonyms
(3Z)444trifluoro1(4methylphenyl)3((4(3nitrophenyl)13thiazol2yl)hydrazinylidene)butan1one
(3Z)444trifluoro1(4methylphenyl)3(2(4(3nitrophenyl)13thiazol2yl)hydrazinylidene)butan1one
CC1=CC=C(C=C1)C(=O)CC(=NNC2=NC(=CS2)C3=CC(=CC=C3)(N+)(=O)(O))C(F)(F)F
Cc1ccc(cc1)C(=O)CC(=NNc1scc(n1)c1cccc(c1)(N+)(=O)(O))C(F)(F)F
InChI=1SC20H15F3N4O3Sc1125713(8612)17(28)1018(20(2122)23)2526192416(113119)1432415(914)27(29)30h2911H10H21H3(H2426)b2518
MFCD06241251
ZINC000016949159
ZINC101389581
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