Vitas-M small molecule compound
methyl 2-({[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL402694
SMILES COc1ccc(cc1)c1nc2c(cnn2c(c1)C(F)(F)F)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2
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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 C25H21F3N4O4S MW 530.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21F3N4O4S/c1-35-14-9-7-13(8-10-14)17-11-19(25(26,27)28)32-21(30-17)16(12-29-32)22(33)31-23-20(24(34)36-2)15-5-3-4-6-18(15)37-23/h7-12H,3-6H2,1-2H3,(H,31,33)InChIKey
MUZVYZOOWGUVFH-UHFFFAOYSA-NSynonyms
333762-88-2333762882
COC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)(F)F)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)OC
InChI=1SC25H21F3N4O4Sc135149713(81014)171119(25(2627)28)3221(3017)16(122932)22(33)312320(24(34)362)15534618(15)3723h712H36H212H3(H3133)
methyl2(((5(4methoxyphenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidin3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((5(4methoxyphenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidine3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01450672
ZINC000000845172
ZINC00845172
ZINC845172
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