Vitas-M small molecule compound

ethyl 2-amino-4-methyl-5-(4-nitro-1H-pyrazol-1-yl)thiophene-3-carboxylate

Catalog ID
STK349633
SMILES CCOC(=O)c1c(N)sc(c1C)n1ncc(c1)[N+](=O)[O-]

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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 C11H12N4O4S MW 296.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N4O4S/c1-3-19-11(16)8-6(2)10(20-9(8)12)14-5-7(4-13-14)15(17)18/h4-5H,3,12H2,1-2H3
InChIKey
IVVSWAZDPMVUDE-UHFFFAOYSA-N
Synonyms
1005613-82-0
1005613820
CCOC(=O)C1=C(SC(=C1C)N2C=C(C=N2)(N+)(=O)(O))N
CCOC(=O)c1c(N)sc(c1C)n1ncc(c1)(N+)(=O)(O)
ethyl2amino4methyl5(4nitro1Hpyrazol1yl)thiophene3carboxylate
ethyl2amino4methyl5(4nitropyrazol1yl)thiophene3carboxylate
ETHYL2AMINO4METHYL5(4NITROPYRAZOLYL)THIOPHENE3CARBOXYLATE
InChI=1SC11H12N4O4Sc131911(16)86(2)10(209(8)12)1457(41314)15(17)18h45H312H212H3
MFCD04969882
ZINC000002537678
ZINC02537678
ZINC2537678

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.