Vitas-M small molecule compound
ethyl 2-({[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STL405231
SMILES CCOC(=O)c1c(NC(=O)c2cc3n(n2)c(cc(n3)c2ccccc2)C(F)(F)F)sc2c1CCCCC2
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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/c1-2-36-25(35)22-16-11-7-4-8-12-19(16)37-24(22)31-23(34)18-14-21-30-17(15-9-5-3-6-10-15)13-20(26(27,28)29)33(21)32-18/h3,5-6,9-10,13-14H,2,4,7-8,11-12H2,1H3,(H,31,34)InChIKey
NHJVRDCINDASAP-UHFFFAOYSA-NSynonyms
353781-31-4353781314
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=NN4C(=CC(=NC4=C3)C5=CC=CC=C5)C(F)(F)F
ethyl2(((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((5phenyl7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC26H23F3N4O3Sc123625(35)2216117481219(16)3724(22)3123(34)1814213017(1595361015)1320(26(2728)29)33(21)3218h3569101314H24781112H21H3(H3134)
MFCD01918932
ZINC000002729013
ZINC02729013
ZINC2729013
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