Vitas-M small molecule compound
diethyl 3-methyl-5-{[(5-nitrofuran-2-yl)carbonyl]amino}thiophene-2,4-dicarboxylate
Catalog ID
STK248113
SMILES CCOC(=O)c1c(NC(=O)c2ccc(o2)[N+](=O)[O-])sc(c1C)C(=O)OCC
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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 C16H16N2O8S MW 396.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O8S/c1-4-24-15(20)11-8(3)12(16(21)25-5-2)27-14(11)17-13(19)9-6-7-10(26-9)18(22)23/h6-7H,4-5H2,1-3H3,(H,17,19)InChIKey
VDCLHJYXXIBLKD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC=C(O2)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2ccc(o2)(N+)(=O)(O))sc(c1C)C(=O)OCC
diethyl3methyl5(((5nitrofuran2yl)carbonyl)amino)thiophene24dicarboxylate
DIETHYL3METHYL5((5NITROFURAN2CARBONYL)AMINO)THIOPHENE24DICARBOXYLATE
DIETHYL5((5NITRO2FUROYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
InChI=1SC16H16N2O8Sc142415(20)118(3)12(16(21)2552)2714(11)1713(19)96710(269)18(22)23h67H45H213H3(H1719)
MFCD03241626
ZINC000002998336
ZINC02998336
ZINC2998336
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