Vitas-M small molecule compound
ethyl 2-({[3-bromo-5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK759448
SMILES CCOC(=O)c1c(NC(=O)c2nn3c(c2Br)nc(cc3C(F)(F)F)c2ccco2)sc2c1CCC(C2)C
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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 C24H20BrF3N4O4S MW 597.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrF3N4O4S/c1-3-35-23(34)17-12-7-6-11(2)9-15(12)37-22(17)30-21(33)19-18(25)20-29-13(14-5-4-8-36-14)10-16(24(26,27)28)32(20)31-19/h4-5,8,10-11H,3,6-7,9H2,1-2H3,(H,30,33)InChIKey
LWVQHJQBTCKCJX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=NN4C(=CC(=NC4=C3Br)C5=CC=CO5)C(F)(F)F
ethyl2(((3bromo5(furan2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((3bromo5(furan2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC24H20BrF3N4O4Sc133523(34)17127611(2)915(12)3722(17)3021(33)1918(25)202913(145483614)1016(24(2627)28)32(20)3119h4581011H3679H212H3(H3033)
MFCD01461512
ZINC000000707197
ZINC000000707198
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