Vitas-M small molecule compound
ethyl 2-[({5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STL396474
SMILES CCOC(=O)c1c(NC(=O)c2ccc(o2)Cn2nc(c(c2C)[N+](=O)[O-])C)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 C20H22N4O6S MW 446.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O6S/c1-6-29-20(26)16-10(2)13(5)31-19(16)21-18(25)15-8-7-14(30-15)9-23-12(4)17(24(27)28)11(3)22-23/h7-8H,6,9H2,1-5H3,(H,21,25)InChIKey
SNZNNWKDNUWJEH-UHFFFAOYSA-NSynonyms
489408-49-3489408493
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)C)(N+)(=O)(O))C
CCOC(=O)c1c(NC(=O)c2ccc(o2)Cn2nc(c(c2C)(N+)(=O)(O))C)sc(c1C)C
ETHYL2(((5((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)FURAN2YL)CARBONYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ETHYL2((5((35DIMETHYL4NITROPYRAZOL1YL)METHYL)FURAN2CARBONYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ETHYL2((5((4NITRO35DIMETHYL1HPYRAZOL1YL)METHYL)2FUROYL)AMINO)45DIMETHYL3THIOPHENECARBOXYLATE
InChI=1SC20H22N4O6Sc162920(26)1610(2)13(5)3119(16)2118(25)158714(3015)92312(4)17(24(27)28)11(3)2223h78H69H215H3(H2125)
MFCD02053681
ZINC000002745011
ZINC02745011
ZINC2745011
Check stock
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Check stock on Vitas-MAvailable files
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