Vitas-M small molecule compound
3-({1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}carbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STL402864
SMILES CCn1ncc(c1)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 C17H21N5O4 MW 359.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O4/c1-2-21-7-10(5-18-21)8-22-9-11(6-19-22)20-16(23)14-12-3-4-13(26-12)15(14)17(24)25/h5-7,9,12-15H,2-4,8H2,1H3,(H,20,23)(H,24,25)InChIKey
ZRMDTSPHWAHCDG-UHFFFAOYSA-NSynonyms
1053068-82-81053068828
2((1((1ethylpyrazol4yl)methyl)pyrazol4yl)carbamoyl)7oxabicyclo(221)heptane3carboxylicacid
3((1((1ethyl1Hpyrazol4yl)methyl)1Hpyrazol4yl)carbamoyl)7oxabicyclo(221)heptane2carboxylicacid
CCN1C=C(C=N1)CN2C=C(C=N2)NC(=O)C3C4CCC(C3C(=O)O)O4
InChI=1SC17H21N5O4c1221710(51821)822911(61922)2016(23)14123413(2612)15(14)17(24)25h5791215H248H21H3(H2023)(H2425)
MFCD04140146
ZINC000226393584
ZINC000239439270
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