Vitas-M small molecule compound
propan-2-yl 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
STL405519
SMILES CC(OC(=O)c1c(NC(=O)c2cc3n(n2)c(cc(n3)c2ccccc2)C(F)(F)F)sc2c1CCCC2)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 C26H23F3N4O3S MW 528.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23F3N4O3S/c1-14(2)36-25(35)22-16-10-6-7-11-19(16)37-24(22)31-23(34)18-13-21-30-17(15-8-4-3-5-9-15)12-20(26(27,28)29)33(21)32-18/h3-5,8-9,12-14H,6-7,10-11H2,1-2H3,(H,31,34)InChIKey
PDEFNIRIXZKJOJ-UHFFFAOYSA-NSynonyms
313248-21-4313248214
CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NN4C(=CC(=NC4=C3)C5=CC=CC=C5)C(F)(F)F
InChI=1SC26H23F3N4O3Sc114(2)3625(35)221610671119(16)3724(22)3123(34)1813213017(158435915)1220(26(2728)29)33(21)3218h35891214H671011H212H3(H3134)
MFCD01451765
propan2yl2(((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002807376
ZINC02807376
ZINC2807376
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