Vitas-M small molecule compound
diethyl 3-methyl-5-{[(4-nitro-1H-pyrazol-1-yl)acetyl]amino}thiophene-2,4-dicarboxylate
Catalog ID
STK776449
SMILES CCOC(=O)c1c(NC(=O)Cn2ncc(c2)[N+](=O)[O-])sc(c1C)C(=O)OCC
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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 C16H18N4O7S MW 410.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O7S/c1-4-26-15(22)12-9(3)13(16(23)27-5-2)28-14(12)18-11(21)8-19-7-10(6-17-19)20(24)25/h6-7H,4-5,8H2,1-3H3,(H,18,21)InChIKey
QWTBVGBYHQOFLQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN2C=C(C=N2)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)Cn2ncc(c2)(N+)(=O)(O))sc(c1C)C(=O)OCC
diethyl3methyl5(((4nitro1Hpyrazol1yl)acetyl)amino)thiophene24dicarboxylate
DIETHYL3METHYL5((2(4NITROPYRAZOL1YL)ACETYL)AMINO)THIOPHENE24DICARBOXYLATE
InChI=1SC16H18N4O7Sc142615(22)129(3)13(16(23)2752)2814(12)1811(21)819710(61719)20(24)25h67H458H213H3(H1821)
MFCD05259024
ZINC000012413661
ZINC12413661
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