Vitas-M small molecule compound

3-({3-[(furan-2-ylmethyl)carbamoyl]-1-methyl-1H-pyrazol-4-yl}carbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

Catalog ID
STK446428
SMILES O=C(C1C2CCC(C1C(=O)O)O2)Nc1cn(nc1C(=O)NCc1ccco1)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 C18H20N4O6 MW 388.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O6/c1-22-8-10(15(21-22)17(24)19-7-9-3-2-6-27-9)20-16(23)13-11-4-5-12(28-11)14(13)18(25)26/h2-3,6,8,11-14H,4-5,7H2,1H3,(H,19,24)(H,20,23)(H,25,26)
InChIKey
HBLOJSVIZRGKLI-UHFFFAOYSA-N
Synonyms

2((3(furan2ylmethylcarbamoyl)1methylpyrazol4yl)carbamoyl)7oxabicyclo(221)heptane3carboxylicacid
3((3((FURAN2YLMETHYL)CARBAMOYL)1METHYL1HPYRAZOL4YL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
3(N(3(N(2FURYLMETHYL)CARBAMOYL)1METHYLPYRAZOL4YL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
CN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)C3C4CCC(C3C(=O)O)O4
InChI=1SC18H20N4O6c122810(15(2122)17(24)1979326279)2016(23)13114512(2811)14(13)18(25)26h23681114H457H21H3(H1924)(H2023)(H2526)
MFCD04058678
ZINC000225690556
ZINC000239308951

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Available files

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