Vitas-M small molecule compound
1-(3,4-dimethylphenyl)-5-ethyl-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STL143188
SMILES CCc1c(nnn1c1ccc(c(c1)C)C)C(=O)O
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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 C13H15N3O2 MW 245.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O2/c1-4-11-12(13(17)18)14-15-16(11)10-6-5-8(2)9(3)7-10/h5-7H,4H2,1-3H3,(H,17,18)InChIKey
MTDHWWUYHQGUPL-UHFFFAOYSA-NSynonyms
1017449-47-61(34dimethylphenyl)5ethyl1H123triazole4carboxylicacid
1(34dimethylphenyl)5ethyltriazole4carboxylicacid
1017449476
CCC1=C(N=NN1C2=CC(=C(C=C2)C)C)C(=O)O
InChI=1SC13H15N3O2c141112(13(17)18)141516(11)10658(2)9(3)710h57H4H213H3(H1718)
MFCD10006832
ZINC000011759436
ZINC11759436
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