Vitas-M small molecule compound

ethyl 4,5-dimethyl-2-{[(3-methyl-4-nitrophenoxy)acetyl]amino}thiophene-3-carboxylate

Catalog ID
STK766194
SMILES CCOC(=O)c1c(NC(=O)COc2ccc(c(c2)C)[N+](=O)[O-])sc(c1C)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 C18H20N2O6S MW 392.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O6S/c1-5-25-18(22)16-11(3)12(4)27-17(16)19-15(21)9-26-13-6-7-14(20(23)24)10(2)8-13/h6-8H,5,9H2,1-4H3,(H,19,21)
InChIKey
RGULZMBRMZIBAG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC2=CC(=C(C=C2)(N+)(=O)(O))C
CCOC(=O)c1c(NC(=O)COc2ccc(c(c2)C)(N+)(=O)(O))sc(c1C)C
ethyl45dimethyl2(((3methyl4nitrophenoxy)acetyl)amino)thiophene3carboxylate
ETHYL45DIMETHYL2((2(3METHYL4NITROPHENOXY)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC18H20N2O6Sc152518(22)1611(3)12(4)2717(16)1915(21)926136714(20(23)24)10(2)813h68H59H214H3(H1921)
MFCD02928216
ZINC000004577020
ZINC04577020
ZINC4577020

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.