Vitas-M small molecule compound
3-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STL395086
SMILES O=C(C1C2CCC(C1C(=O)O)O2)NCCCn1nc(cc1C)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 C16H23N3O4 MW 321.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N3O4/c1-9-8-10(2)19(18-9)7-3-6-17-15(20)13-11-4-5-12(23-11)14(13)16(21)22/h8,11-14H,3-7H2,1-2H3,(H,17,20)(H,21,22)InChIKey
GXSOIEZNSLSJSW-UHFFFAOYSA-NSynonyms
1024259-49-11024259491
2(3(35DIMETHYLPYRAZOL1YL)PROPYLCARBAMOYL)7OXABICYCLO(221)HEPTANE3CARBOXYLICACID
3((3(35DIMETHYL1HPYRAZOL1YL)PROPYL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
CC1=CC(=NN1CCCNC(=O)C2C3CCC(C2C(=O)O)O3)C
InChI=1SC16H23N3O4c19810(2)19(189)7361715(20)13114512(2311)14(13)16(21)22h81114H37H212H3(H1720)(H2122)
MFCD04129471
ZINC000226373523
ZINC000245226067
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