Vitas-M small molecule compound
ethyl 2-{[(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK967622
SMILES CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)Cl)[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 C16H17ClN4O5S MW 412.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O5S/c1-3-26-16(23)12-9-5-4-6-10(9)27-15(12)18-11(22)7-20-8(2)13(17)14(19-20)21(24)25/h3-7H2,1-2H3,(H,18,22)InChIKey
AYJHKKWVYOSEBQ-UHFFFAOYSA-NSynonyms
355804-95-4355804954
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CN3C(=C(C(=N3)(N+)(=O)(O))Cl)C
CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)Cl)(N+)(=O)(O))sc2c1CCC2
ETHYL2(((4CHLORO3NITRO5METHYL1HPYRAZOL1YL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ethyl2(((4chloro5methyl3nitro1Hpyrazol1yl)acetyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ETHYL2((2(4CHLORO5METHYL3NITROPYRAZOL1YL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ethyl2(2(4chloro5methyl3nitro1Hpyrazol1yl)acetamido)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ETHYL2(2(4CHLORO5METHYL3NITROPYRAZOLYL)ACETYLAMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
InChI=1SC16H17ClN4O5Sc132616(23)12954610(9)2715(12)1811(22)7208(2)13(17)14(1920)21(24)25h37H212H3(H1822)
MFCD01451814
ZINC000000845099
ZINC00845099
ZINC845099
Check stock
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Check stock on Vitas-MAvailable files
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