Vitas-M small molecule compound
4-ethyl 2-methyl 5-{[(3,5-dinitrophenyl)carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK453276
SMILES CCOC(=O)c1c(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])sc(c1C)C(=O)OC
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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 C17H15N3O9S MW 437.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O9S/c1-4-29-16(22)12-8(2)13(17(23)28-3)30-15(12)18-14(21)9-5-10(19(24)25)7-11(6-9)20(26)27/h5-7H,4H2,1-3H3,(H,18,21)InChIKey
GGNOTFYLKSTUDH-UHFFFAOYSA-NSynonyms
4ethyl2methyl5(((35dinitrophenyl)carbonyl)amino)3methylthiophene24dicarboxylate
4ETHYL2METHYL5((35DINITROBENZOYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
4OETHYL2OMETHYL5((35DINITROBENZOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2cc(cc(c2)(N+)(=O)(O))(N+)(=O)(O))sc(c1C)C(=O)OC
InChI=1SC17H15N3O9Sc142916(22)128(2)13(17(23)283)3015(12)1814(21)9510(19(24)25)711(69)20(26)27h57H4H213H3(H1821)
METHYL5((35DINITROPHENYL)CARBONYLAMINO)4(ETHOXYCARBONYL)3METHYLTHIOPHENE2CARBOXYLATE
MFCD02606064
ZINC000002760014
ZINC02760014
ZINC2760014
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