Vitas-M small molecule compound
3-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}carbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK311729
SMILES CCn1ncc(c1C)Cn1ncc(c1)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 C18H23N5O4 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O4/c1-3-23-10(2)11(6-20-23)8-22-9-12(7-19-22)21-17(24)15-13-4-5-14(27-13)16(15)18(25)26/h6-7,9,13-16H,3-5,8H2,1-2H3,(H,21,24)(H,25,26)InChIKey
PPQOYZMMWPSTTC-UHFFFAOYSA-NSynonyms
1052576-33-61052576336
2((1((1ethyl5methylpyrazol4yl)methyl)pyrazol4yl)carbamoyl)7oxabicyclo(221)heptane3carboxylicacid
3((1((1ethyl5methyl1Hpyrazol4yl)methyl)1Hpyrazol4yl)carbamoyl)7oxabicyclo(221)heptane2carboxylicacid
CCN1C(=C(C=N1)CN2C=C(C=N2)NC(=O)C3C4CCC(C3C(=O)O)O4)C
InChI=1SC18H23N5O4c132310(2)11(62023)822912(71922)2117(24)15134514(2713)16(15)18(25)26h6791316H358H212H3(H2124)(H2526)
MFCD04139877
ZINC000226563297
ZINC000239174253
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