Vitas-M small molecule compound
1-(5-methyl-1,2-oxazol-3-yl)-5-oxo-7-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
Catalog ID
STL435376
SMILES O=C1CC(c2c(N1)c(cn2c1noc(c1)C)C(=O)O)C(F)(F)F
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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 C13H10F3N3O4 MW 329.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10F3N3O4/c1-5-2-8(18-23-5)19-4-6(12(21)22)10-11(19)7(13(14,15)16)3-9(20)17-10/h2,4,7H,3H2,1H3,(H,17,20)(H,21,22)InChIKey
MRBNAEYLVBXFNG-UHFFFAOYSA-NSynonyms
1(5METHYL12OXAZOL3YL)5OXO7(TRIFLUOROMETHYL)1H4H5H6H7HPYRROLO(32B)PYRIDINE3CARBOXYLICACID
1(5methyl12oxazol3yl)5oxo7(trifluoromethyl)4567tetrahydro1Hpyrrolo(32b)pyridine3carboxylicacid
1(5methyl12oxazol3yl)5oxo7(trifluoromethyl)67dihydro4Hpyrrolo(32b)pyridine3carboxylicacid
CC1=CC(=NO1)N2C=C(C3=C2C(CC(=O)N3)C(F)(F)F)C(=O)O
InChI=1SC13H10F3N3O4c1528(18235)1946(12(21)22)1011(19)7(13(1415)16)39(20)1710h247H3H21H3(H1720)(H2122)
MFCD25975258
ZINC000066087673
ZINC000066087674
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