Vitas-M small molecule compound
methyl 4-methyl-3-({3-[2-methyl-6-oxo-4-(trifluoromethyl)-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanoyl}amino)benzoate
Catalog ID
STL401539
SMILES COC(=O)c1ccc(c(c1)NC(=O)CCn1c(=O)cc(c2c1nn(c2)C)C(F)(F)F)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 C20H19F3N4O4 MW 436.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N4O4/c1-11-4-5-12(19(30)31-3)8-15(11)24-16(28)6-7-27-17(29)9-14(20(21,22)23)13-10-26(2)25-18(13)27/h4-5,8-10H,6-7H2,1-3H3,(H,24,28)InChIKey
GRYPDJYHNAFKPX-UHFFFAOYSA-NSynonyms
1174852-70-01174852700
CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCN2C(=O)C=C(C3=CN(N=C32)C)C(F)(F)F
InChI=1SC20H19F3N4O4c1114512(19(30)313)815(11)2416(28)672717(29)914(20(2122)23)131026(2)2518(13)27h45810H67H213H3(H2428)
methyl4methyl3((3(2methyl6oxo4(trifluoromethyl)26dihydro7Hpyrazolo(34b)pyridin7yl)propanoyl)amino)benzoate
methyl4methyl3(3(2methyl6oxo4(trifluoromethyl)pyrazolo(34b)pyridin7yl)propanoylamino)benzoate
MFCD12025551
ZINC000036621449
ZINC36621449
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