Vitas-M small molecule compound
ethyl 2-{[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STL405513
SMILES CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)[N+](=O)[O-])C)sc2c1CCCCC2
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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 C19H24N4O5S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N4O5S/c1-4-28-19(25)16-13-8-6-5-7-9-14(13)29-18(16)20-15(24)10-22-12(3)17(23(26)27)11(2)21-22/h4-10H2,1-3H3,(H,20,24)InChIKey
RVSLEZLFMSLKDB-UHFFFAOYSA-NSynonyms
488782-97-4488782974
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CN3C(=C(C(=N3)C)(N+)(=O)(O))C
CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)(N+)(=O)(O))C)sc2c1CCCCC2
ethyl2(((35dimethyl4nitro1Hpyrazol1yl)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((2(35dimethyl4nitropyrazol1yl)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC19H24N4O5Sc142819(25)16138657914(13)2918(16)2015(24)102212(3)17(23(26)27)11(2)2122h410H213H3(H2024)
MFCD01449744
ZINC000000865291
ZINC00865291
ZINC865291
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