Vitas-M small molecule compound
methyl 4,5-dimethyl-2-{[(3-methyl-4-nitrophenoxy)acetyl]amino}thiophene-3-carboxylate
Catalog ID
STK766195
SMILES COC(=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 C17H18N2O6S MW 378.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O6S/c1-9-7-12(5-6-13(9)19(22)23)25-8-14(20)18-16-15(17(21)24-4)10(2)11(3)26-16/h5-7H,8H2,1-4H3,(H,18,20)InChIKey
SYUGETFUYVEFOV-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)OCC(=O)NC2=C(C(=C(S2)C)C)C(=O)OC)(N+)(=O)(O)
COC(=O)c1c(NC(=O)COc2ccc(c(c2)C)(N+)(=O)(O))sc(c1C)C
InChI=1SC17H18N2O6Sc19712(5613(9)19(22)23)25814(20)181615(17(21)244)10(2)11(3)2616h57H8H214H3(H1820)
methyl45dimethyl2(((3methyl4nitrophenoxy)acetyl)amino)thiophene3carboxylate
METHYL45DIMETHYL2((2(3METHYL4NITROPHENOXY)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD02928353
ZINC000004577025
ZINC04577025
ZINC4577025
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