Vitas-M small molecule compound
ethyl 2-{[(3-nitro-1H-pyrazol-1-yl)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK779630
SMILES CCOC(=O)c1c(NC(=O)Cn2ccc(n2)[N+](=O)[O-])sc2c1CCC2
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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 C15H16N4O5S MW 364.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O5S/c1-2-24-15(21)13-9-4-3-5-10(9)25-14(13)16-12(20)8-18-7-6-11(17-18)19(22)23/h6-7H,2-5,8H2,1H3,(H,16,20)InChIKey
BPUPHORISKUAQY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CN3C=CC(=N3)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)Cn2ccc(n2)(N+)(=O)(O))sc2c1CCC2
ethyl2(((3nitro1Hpyrazol1yl)acetyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ETHYL2((2(3NITROPYRAZOL1YL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
InChI=1SC15H16N4O5Sc122415(21)13943510(9)2514(13)1612(20)8187611(1718)19(22)23h67H258H21H3(H1620)
MFCD05858771
ZINC000001429935
ZINC01429935
ZINC1429935
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