Vitas-M small molecule compound
ethyl 4-methyl-2-{[(3-nitrophenyl)carbonyl]amino}-5-propanoylthiophene-3-carboxylate
Catalog ID
STK530104
SMILES CCOC(=O)c1c(NC(=O)c2cccc(c2)[N+](=O)[O-])sc(c1C)C(=O)CC
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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/c1-4-13(21)15-10(3)14(18(23)26-5-2)17(27-15)19-16(22)11-7-6-8-12(9-11)20(24)25/h6-9H,4-5H2,1-3H3,(H,19,22)InChIKey
FJKXHJHHXIRYGX-UHFFFAOYSA-NSynonyms
CCC(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OCC)C
CCOC(=O)c1c(NC(=O)c2cccc(c2)(N+)(=O)(O))sc(c1C)C(=O)CC
ethyl4methyl2(((3nitrophenyl)carbonyl)amino)5propanoylthiophene3carboxylate
ETHYL4METHYL2((3NITROBENZOYL)AMINO)5PROPANOYLTHIOPHENE3CARBOXYLATE
ethyl4methyl2(3nitrobenzamido)5propionylthiophene3carboxylate
InChI=1SC18H18N2O6Sc1413(21)1510(3)14(18(23)2652)17(2715)1916(22)1176812(911)20(24)25h69H45H213H3(H1922)
MFCD00989068
ZINC000004834611
ZINC04834611
ZINC4834611
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