Vitas-M small molecule compound
1-(2,5-dimethylbenzyl)-5-ethyl-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STL190738
SMILES CCc1n(nnc1C(=O)O)Cc1cc(C)ccc1C
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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 C14H17N3O2 MW 259.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O2/c1-4-12-13(14(18)19)15-16-17(12)8-11-7-9(2)5-6-10(11)3/h5-7H,4,8H2,1-3H3,(H,18,19)InChIKey
UIZONXBOEVHCEM-UHFFFAOYSA-NSynonyms
1281832-74-31((25dimethylphenyl)methyl)5ethyltriazole4carboxylicacid
1(25dimethylbenzyl)5ethyl1H123triazole4carboxylicacid
1281832743
CCC1=C(N=NN1CC2=C(C=CC(=C2)C)C)C(=O)O
InChI=1SC14H17N3O2c141213(14(18)19)151617(12)81179(2)5610(11)3h57H48H213H3(H1819)
MFCD17927441
ZINC000050214252
ZINC50214252
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