Vitas-M small molecule compound
methyl 5-[(1E)-1-(dimethylamino)-4,4,4-trifluoro-3-oxobut-1-en-2-yl]-3-phenyl-1,2-thiazole-4-carboxylate
Catalog ID
STL442425
SMILES COC(=O)c1c(nsc1/C(=C/N(C)C)/C(=O)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 C17H15F3N2O3S MW 384.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15F3N2O3S/c1-22(2)9-11(15(23)17(18,19)20)14-12(16(24)25-3)13(21-26-14)10-7-5-4-6-8-10/h4-9H,1-3H3/b11-9-InChIKey
IATHJTGBJNPKOB-LUAWRHEFSA-NSynonyms
CN(C)C=C(C1=C(C(=NS1)C2=CC=CC=C2)C(=O)OC)C(=O)C(F)(F)F
COC(=O)c1c(nsc1C(=CN(C)C)C(=O)C(F)(F)F)c1ccccc1
InChI=1SC17H15F3N2O3Sc122(2)911(15(23)17(1819)20)1412(16(24)253)13(212614)107546810h49H13H3b119
methyl5((1E)1(dimethylamino)444trifluoro3oxobut1en2yl)3phenyl12thiazole4carboxylate
methyl5((E)1(dimethylamino)444trifluoro3oxobut1en2yl)3phenyl12thiazole4carboxylate
MFCD29709937
ZINC000096319549
ZINC96319549
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