Vitas-M small molecule compound
ethyl 5-acetyl-4-methyl-2-{[(2-methyl-3-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK438185
SMILES CCOC(=O)c1c(NC(=O)c2cccc(c2C)[N+](=O)[O-])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 C18H18N2O6S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O6S/c1-5-26-18(23)14-10(3)15(11(4)21)27-17(14)19-16(22)12-7-6-8-13(9(12)2)20(24)25/h6-8H,5H2,1-4H3,(H,19,22)InChIKey
OBAWHMDOCUIRTB-UHFFFAOYSA-NSynonyms
5ACETYL4METHYL2(2METHYL3NITROBENZOYLAMINO)THIOPHENE3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=C(C(=CC=C2)(N+)(=O)(O))C
CCOC(=O)c1c(NC(=O)c2cccc(c2C)(N+)(=O)(O))sc(c1C)C(=O)C
ETHYL5ACETYL2((3NITRO2METHYLBENZOYL)AMINO)4METHYL3THIOPHENECARBOXYLATE
ethyl5acetyl4methyl2(((2methyl3nitrophenyl)carbonyl)amino)thiophene3carboxylate
ETHYL5ACETYL4METHYL2((2METHYL3NITROBENZOYL)AMINO)3THIOPHENECARBOXYLATE
ETHYL5ACETYL4METHYL2((2METHYL3NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC18H18N2O6Sc152618(23)1410(3)15(11(4)21)2717(14)1916(22)1276813(9(12)2)20(24)25h68H5H214H3(H1922)
MFCD03015937
ZINC000000670963
ZINC00670963
ZINC670963
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