Vitas-M small molecule compound
methyl 6-methyl-2-({[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL329714
SMILES COC(=O)c1c(NC(=O)c2cnn3c2nc(cc3C(F)(F)F)c2ccccc2)sc2c1CCC(C2)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 C25H21F3N4O3S MW 514.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21F3N4O3S/c1-13-8-9-15-18(10-13)36-23(20(15)24(34)35-2)31-22(33)16-12-29-32-19(25(26,27)28)11-17(30-21(16)32)14-6-4-3-5-7-14/h3-7,11-13H,8-10H2,1-2H3,(H,31,33)InChIKey
WXAFVLVWEZRUEG-UHFFFAOYSA-NSynonyms
330947-58-5330947585
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=C4N=C(C=C(N4N=C3)C(F)(F)F)C5=CC=CC=C5
InChI=1SC25H21F3N4O3Sc113891518(1013)3623(20(15)24(34)352)3122(33)1612293219(25(2627)28)1117(3021(16)32)146435714h371113H810H212H3(H3133)
methyl6methyl2(((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidin3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6methyl2((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidine3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6methyl2(5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidine3carboxamido)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD01451901
ZINC000002084482
ZINC000002084483
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