Vitas-M small molecule compound
1-(2,4-dimethylphenyl)-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STL119930
SMILES Cc1ccc(c(c1)C)n1nnc(c1C(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 C14H17N3O2 MW 259.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O2/c1-8(2)13-12(14(18)19)15-16-17(13)11-6-5-9(3)7-10(11)4/h5-8H,1-4H3,(H,18,19)InChIKey
IIZPDKYVXPXOBJ-UHFFFAOYSA-NSynonyms
1(24dimethylphenyl)5(propan2yl)1H123triazole4carboxylicacid
1(24dimethylphenyl)5propan2yltriazole4carboxylicacid
CC1=CC(=C(C=C1)N2C(=C(N=N2)C(=O)O)C(C)C)C
InChI=1SC14H17N3O2c18(2)1312(14(18)19)151617(13)11659(3)710(11)4h58H14H3(H1819)
MFCD12633407
ZINC000019813410
ZINC19813410
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