Vitas-M small molecule compound
ethyl 5-acetyl-2-{[4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanoyl]amino}-4-methylthiophene-3-carboxylate
Catalog ID
STK779674
SMILES CCOC(=O)c1c(NC(=O)CCCn2nc(c(c2C)[N+](=O)[O-])C)sc(c1C)C(=O)C
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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 C19H24N4O6S MW 436.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N4O6S/c1-6-29-19(26)15-10(2)17(13(5)24)30-18(15)20-14(25)8-7-9-22-12(4)16(23(27)28)11(3)21-22/h6-9H2,1-5H3,(H,20,25)InChIKey
XOZOBSZFPKORDN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCCN2C(=C(C(=N2)C)(N+)(=O)(O))C
CCOC(=O)c1c(NC(=O)CCCn2nc(c(c2C)(N+)(=O)(O))C)sc(c1C)C(=O)C
ethyl5acetyl2((4(35dimethyl4nitro1Hpyrazol1yl)butanoyl)amino)4methylthiophene3carboxylate
ETHYL5ACETYL2(4(35DIMETHYL4NITROPYRAZOL1YL)BUTANOYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC19H24N4O6Sc162919(26)1510(2)17(13(5)24)3018(15)2014(25)8792212(4)16(23(27)28)11(3)2122h69H215H3(H2025)
MFCD05859005
ZINC000012413646
ZINC12413646
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