Vitas-M small molecule compound
3-[(3-methyl-1H-pyrazol-4-yl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STL396863
SMILES O=C(C1C2CCC(C1C(=O)O)O2)Nc1c[nH]nc1C
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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 C12H15N3O4 MW 265.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O4/c1-5-6(4-13-15-5)14-11(16)9-7-2-3-8(19-7)10(9)12(17)18/h4,7-10H,2-3H2,1H3,(H,13,15)(H,14,16)(H,17,18)InChIKey
VFEPIDIOIQLIGC-UHFFFAOYSA-NSynonyms
1212162-00-91212162009
2((5methyl1Hpyrazol4yl)carbamoyl)7oxabicyclo(221)heptane3carboxylicacid
3((3METHYL1HPYRAZOL4YL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
CC1=C(C=NN1)NC(=O)C2C3CCC(C2C(=O)O)O3
InChI=1SC12H15N3O4c156(413155)1411(16)97238(197)10(9)12(17)18h4710H23H21H3(H1315)(H1416)(H1718)
MFCD04140896
O=C(C1C2CCC(C1C(=O)O)O2)Nc1c(nH)nc1C
ZINC000226394515
ZINC000239425757
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