Vitas-M small molecule compound
ethyl 6-tert-butyl-2-({[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK838369
SMILES CCOC(=O)c1c(NC(=O)c2nn3c(c2)nc(cc3C(F)(F)F)c2ccccc2)sc2c1CCC(C2)C(C)(C)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 C29H29F3N4O3S MW 570.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29F3N4O3S/c1-5-39-27(38)24-18-12-11-17(28(2,3)4)13-21(18)40-26(24)34-25(37)20-15-23-33-19(16-9-7-6-8-10-16)14-22(29(30,31)32)36(23)35-20/h6-10,14-15,17H,5,11-13H2,1-4H3,(H,34,37)InChIKey
MEMCYFDQKKCNFI-UHFFFAOYSA-NSynonyms
313248-22-5313248225
CCOC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC(=O)C3=NN4C(=CC(=NC4=C3)C5=CC=CC=C5)C(F)(F)F
ethyl6(tertbutyl)2(5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxamido)4567tetrahydrobenzo(b)thiophene3carboxylate
ethyl6tertbutyl2(((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6tertbutyl2((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC29H29F3N4O3Sc153927(38)2418121117(28(23)4)1321(18)4026(24)3425(37)2015233319(1697681016)1422(29(3031)32)36(23)3520h610141517H51113H214H3(H3437)
MFCD01451759
ZINC000002604554
ZINC000002604555
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