Vitas-M small molecule compound
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methyl}-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STK770546
SMILES CCOC(=O)c1nnn(c1CNc1c(C)n(n(c1=O)c1ccccc1)C)c1nonc1N
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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 C19H21N9O4 MW 439.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N9O4/c1-4-31-19(30)15-13(27(25-22-15)17-16(20)23-32-24-17)10-21-14-11(2)26(3)28(18(14)29)12-8-6-5-7-9-12/h5-9,21H,4,10H2,1-3H3,(H2,20,23)InChIKey
WVIYXFZTKUJEFY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CNC3=C(N(N(C3=O)C4=CC=CC=C4)C)C
ethyl1(4amino125oxadiazol3yl)5(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)amino)methyl)1H123triazole4carboxylate
ETHYL1(4AMINO125OXADIAZOL3YL)5(((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)AMINO)METHYL)TRIAZOLE4CARBOXYLATE
InChI=1SC19H21N9O4c143119(30)1513(27(252215)1716(20)23322417)10211411(2)26(3)28(18(14)29)128657912h5921H410H213H3(H22023)
MFCD03766295
ZINC000003623134
ZINC03623134
ZINC3623134
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