Vitas-M small molecule compound
ethyl 2-{(2Z)-2-[4-(4-bromophenyl)-1,1,1-trifluoro-4-oxobutan-2-ylidene]hydrazinyl}-1,3-thiazole-4-carboxylate
Catalog ID
STL438153
SMILES CCOC(=O)c1csc(n1)N/N=C(\C(F)(F)F)/CC(=O)c1ccc(cc1)Br
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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 C16H13BrF3N3O3S MW 464.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrF3N3O3S/c1-2-26-14(25)11-8-27-15(21-11)23-22-13(16(18,19)20)7-12(24)9-3-5-10(17)6-4-9/h3-6,8H,2,7H2,1H3,(H,21,23)/b22-13-InChIKey
IOKFUKHSRQPVPN-XKZIYDEJSA-NSynonyms
CCOC(=O)C1=CSC(=N1)NN=C(CC(=O)C2=CC=C(C=C2)Br)C(F)(F)F
CCOC(=O)c1csc(n1)NN=C(C(F)(F)F)CC(=O)c1ccc(cc1)Br
ethyl2((2Z)2(4(4bromophenyl)111trifluoro4oxobutan2ylidene)hydrazinyl)13thiazole4carboxylate
InChI=1SC16H13BrF3N3O3Sc122614(25)1182715(2111)232213(16(1819)20)712(24)93510(17)649h368H27H21H3(H2123)b2213
MFCD06241250
ZINC000008694811
ZINC1415008
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