Vitas-M small molecule compound
ethyl 3-(2,5-dimethyl-3-{(E)-[2-(thiophen-2-ylcarbonyl)hydrazinylidene]methyl}-1H-pyrrol-1-yl)benzoate
Catalog ID
STK111250
SMILES CCOC(=O)c1cccc(c1)n1c(C)cc(c1C)/C=N/NC(=O)c1cccs1
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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 C21H21N3O3S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S/c1-4-27-21(26)16-7-5-8-18(12-16)24-14(2)11-17(15(24)3)13-22-23-20(25)19-9-6-10-28-19/h5-13H,4H2,1-3H3,(H,23,25)/b22-13+InChIKey
DPNULDROSTUMPN-LPYMAVHISA-NSynonyms
CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=C2C)C=NNC(=O)C3=CC=CS3)C
CCOC(=O)c1cccc(c1)n1c(C)cc(c1C)C=NNC(=O)c1cccs1
ETHYL3(25DIMETHYL3((E)(2(THIOPHEN2YLCARBONYL)HYDRAZINYLIDENE)METHYL)1HPYRROL1YL)BENZOATE
ethyl3(25dimethyl3((E)(thiophene2carbonylhydrazinylidene)methyl)pyrrol1yl)benzoate
InChI=1SC21H21N3O3Sc142721(26)1675818(1216)2414(2)1117(15(24)3)13222320(25)1996102819h513H4H213H3(H2325)b2213+
MFCD03238899
ZINC000004675255
ZINC33412193
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