Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-ethoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STK583102
SMILES CCOc1cccc(c1)c1c(nnn1c1nonc1N)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 C13H12N6O4 MW 316.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N6O4/c1-2-22-8-5-3-4-7(6-8)10-9(13(20)21)15-18-19(10)12-11(14)16-23-17-12/h3-6H,2H2,1H3,(H2,14,16)(H,20,21)InChIKey
ZDDSZTLHVZFCDU-UHFFFAOYSA-NSynonyms
898104-92-21(4amino125oxadiazol3yl)5(3ethoxyphenyl)1H123triazole4carboxylicacid
1(4AMINO125OXADIAZOL3YL)5(3ETHOXYPHENYL)TRIAZOLE4CARBOXYLICACID
898104922
CCOC1=CC=CC(=C1)C2=C(N=NN2C3=NON=C3N)C(=O)O
InChI=1SC13H12N6O4c122285347(68)109(13(20)21)151819(10)1211(14)16231712h36H2H21H3(H21416)(H2021)
MFCD07641374
ZINC000005451985
ZINC5451985
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