Vitas-M small molecule compound
methyl 2-({[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL403643
SMILES COC(=O)c1c(NC(=O)c2cc3n(n2)c(cc(n3)c2cccs2)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 C22H17F3N4O3S2 MW 506.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F3N4O3S2/c1-32-21(31)18-11-5-2-3-6-14(11)34-20(18)27-19(30)13-10-17-26-12(15-7-4-8-33-15)9-16(22(23,24)25)29(17)28-13/h4,7-10H,2-3,5-6H2,1H3,(H,27,30)InChIKey
OQOUKAJDCSYWOH-UHFFFAOYSA-NSynonyms
313248-55-4313248554
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NN4C(=CC(=NC4=C3)C5=CC=CS5)C(F)(F)F
InChI=1SC22H17F3N4O3S2c13221(31)1811523614(11)3420(18)2719(30)1310172612(157483315)916(22(2324)25)29(17)2813h4710H2356H21H3(H2730)
methyl2(((5(thiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((5thiophen2yl7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01450722
ZINC000000845356
ZINC00845356
ZINC845356
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