Vitas-M small molecule compound
ethyl 2-({[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
STL330739
SMILES CCOC(=O)c1c(NC(=O)c2nn3c(c2)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 C24H21F3N4O4S MW 518.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21F3N4O4S/c1-3-34-23(33)20-13-7-6-12(2)9-17(13)36-22(20)29-21(32)15-11-19-28-14(16-5-4-8-35-16)10-18(24(25,26)27)31(19)30-15/h4-5,8,10-12H,3,6-7,9H2,1-2H3,(H,29,32)InChIKey
KQDIECARRASPPS-UHFFFAOYSA-NSynonyms
313248-45-2313248452
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=NN4C(=CC(=NC4=C3)C5=CC=CO5)C(F)(F)F
ethyl2(((5(furan2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((5(furan2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2(5(furan2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxamido)6methyl4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC24H21F3N4O4Sc133423(33)20137612(2)917(13)3622(20)2921(32)1511192814(165483516)1018(24(2526)27)31(19)3015h4581012H3679H212H3(H2932)
MFCD01244410
ZINC000000649903
ZINC000002092702
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