Vitas-M small molecule compound
3-{[4-(ethoxycarbonyl)-1H-pyrazol-5-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Catalog ID
STL391293
SMILES CCOC(=O)c1cn[nH]c1NC(=O)c1nn(cc1C(=O)O)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 C12H13N5O5 MW 307.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N5O5/c1-3-22-12(21)6-4-13-15-9(6)14-10(18)8-7(11(19)20)5-17(2)16-8/h4-5H,3H2,1-2H3,(H,19,20)(H2,13,14,15,18)InChIKey
JIBGGHCOXLBNDD-UHFFFAOYSA-NSynonyms
1195900-45-81195900458
3((4(ethoxycarbonyl)1Hpyrazol5yl)carbamoyl)1methyl1Hpyrazole4carboxylicacid
3((4ethoxycarbonyl1Hpyrazol5yl)carbamoyl)1methylpyrazole4carboxylicacid
CCOC(=O)C1=C(NN=C1)NC(=O)C2=NN(C=C2C(=O)O)C
CCOC(=O)c1cn(nH)c1NC(=O)c1nn(cc1C(=O)O)C
InChI=1SC12H13N5O5c132212(21)6413159(6)1410(18)87(11(19)20)517(2)168h45H3H212H3(H1920)(H213141518)
MFCD09474080
ZINC000020615818
ZINC20615818
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