Vitas-M small molecule compound
methyl 3-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)propanoate
Catalog ID
STL308839
SMILES COC(=O)CC(c1c(C)[nH]nc1O)c1ccc2c(c1)n(C)c(=O)n2C
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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 C17H20N4O4 MW 344.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O4/c1-9-15(16(23)19-18-9)11(8-14(22)25-4)10-5-6-12-13(7-10)21(3)17(24)20(12)2/h5-7,11H,8H2,1-4H3,(H2,18,19,23)InChIKey
LFYURYPRDIVCCB-UHFFFAOYSA-NSynonyms
1435907-34-81435907348
CC1=C(C(=O)NN1)C(CC(=O)OC)C2=CC3=C(C=C2)N(C(=O)N3C)C
COC(=O)CC(c1c(C)(nH)nc1O)c1ccc2c(c1)n(C)c(=O)n2C
InChI=1SC17H20N4O4c1915(16(23)19189)11(814(22)254)10561213(710)21(3)17(24)20(12)2h5711H8H214H3(H2181923)
methyl3(13dimethyl2oxo23dihydro1Hbenzimidazol5yl)3(3hydroxy5methyl1Hpyrazol4yl)propanoate
methyl3(13dimethyl2oxobenzimidazol5yl)3(3methyl5oxo12dihydropyrazol4yl)propanoate
MFCD28028595
ZINC000095472135
ZINC000095472136
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