Vitas-M small molecule compound
methyl 2-({[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STL329570
SMILES COC(=O)c1c(sc2c1CCCCC2)NC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccccc1
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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 C25H21F3N4O3S MW 514.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21F3N4O3S/c1-35-24(34)20-15-10-6-3-7-11-18(15)36-23(20)31-22(33)16-13-29-32-19(25(26,27)28)12-17(30-21(16)32)14-8-4-2-5-9-14/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3,(H,31,33)InChIKey
IQMKKNRMLHJBAE-UHFFFAOYSA-NSynonyms
312699-28-8312699288
COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=C4N=C(C=C(N4N=C3)C(F)(F)F)C5=CC=CC=C5
InChI=1SC25H21F3N4O3Sc13524(34)2015106371118(15)3623(20)3122(33)1613293219(25(2627)28)1217(3021(16)32)148425914h245891213H3671011H21H3(H3133)
methyl2(((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidin3yl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidine3carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2(5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidine3carboxamido)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01919407
ZINC000002084472
ZINC02084472
ZINC2084472
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