Vitas-M small molecule compound
ethyl 2-({[5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK956269
SMILES CCOC(=O)c1c(NC(=O)c2cc3n(n2)c(cc(n3)C2CC2)C(F)(F)F)sc2c1CCCC2
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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 C22H21F3N4O3S MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F3N4O3S/c1-2-32-21(31)18-12-5-3-4-6-15(12)33-20(18)27-19(30)14-10-17-26-13(11-7-8-11)9-16(22(23,24)25)29(17)28-14/h9-11H,2-8H2,1H3,(H,27,30)InChIKey
WGXPCEHTGDLJQP-UHFFFAOYSA-NSynonyms
438225-10-6438225106
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NN4C(=CC(=NC4=C3)C5CC5)C(F)(F)F
ethyl2(((5cyclopropyl7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((5cyclopropyl7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H21F3N4O3Sc123221(31)1812534615(12)3320(18)2719(30)1410172613(117811)916(22(2324)25)29(17)2814h911H28H21H3(H2730)
MFCD03074901
ZINC000002749555
ZINC02749555
ZINC2749555
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