Vitas-M small molecule compound
3-{[1-methyl-5-(propylcarbamoyl)-1H-pyrazol-4-yl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK311707
SMILES CCCNC(=O)c1c(cnn1C)NC(=O)C1C2CCC(C1C(=O)O)O2
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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 C16H22N4O5 MW 350.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N4O5/c1-3-6-17-15(22)13-8(7-18-20(13)2)19-14(21)11-9-4-5-10(25-9)12(11)16(23)24/h7,9-12H,3-6H2,1-2H3,(H,17,22)(H,19,21)(H,23,24)InChIKey
APUXDRCNECXRIV-UHFFFAOYSA-NSynonyms
1052574-49-81052574498
2((1methyl5(propylcarbamoyl)pyrazol4yl)carbamoyl)7oxabicyclo(221)heptane3carboxylicacid
3((1methyl5(propylcarbamoyl)1Hpyrazol4yl)carbamoyl)7oxabicyclo(221)heptane2carboxylicacid
CCCNC(=O)C1=C(C=NN1C)NC(=O)C2C3CCC(C2C(=O)O)O3
InChI=1SC16H22N4O5c1361715(22)138(71820(13)2)1914(21)1194510(259)12(11)16(23)24h7912H36H212H3(H1722)(H1921)(H2324)
MFCD04139830
ZINC000226557150
ZINC000239274733
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