Vitas-M small molecule compound
4-ethyl 2-methyl 3-methyl-5-({[5-(3-nitrophenyl)furan-2-yl]carbonyl}amino)thiophene-2,4-dicarboxylate
Catalog ID
STK355384
SMILES CCOC(=O)c1c(NC(=O)c2ccc(o2)c2cccc(c2)[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 C21H18N2O8S MW 458.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O8S/c1-4-30-20(25)16-11(2)17(21(26)29-3)32-19(16)22-18(24)15-9-8-14(31-15)12-6-5-7-13(10-12)23(27)28/h5-10H,4H2,1-3H3,(H,22,24)InChIKey
WZSMJIKBJDRKKE-UHFFFAOYSA-NSynonyms
4ethyl2methyl3methyl5(((5(3nitrophenyl)furan2yl)carbonyl)amino)thiophene24dicarboxylate
4OETHYL2OMETHYL3METHYL5((5(3NITROPHENYL)FURAN2CARBONYL)AMINO)THIOPHENE24DICARBOXYLATE
CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2ccc(o2)c2cccc(c2)(N+)(=O)(O))sc(c1C)C(=O)OC
InChI=1SC21H18N2O8Sc143020(25)1611(2)17(21(26)293)3219(16)2218(24)159814(3115)1265713(1012)23(27)28h510H4H213H3(H2224)
MFCD05830468
ZINC000002874730
ZINC02874730
ZINC2874730
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