Vitas-M small molecule compound

ethyl 4-[(4-nitrophenyl)carbamoyl]-1H-imidazole-5-carboxylate

Catalog ID
STK835760
SMILES CCOC(=O)c1[nH]cnc1C(=O)Nc1ccc(cc1)[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 C13H12N4O5 MW 304.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O5/c1-2-22-13(19)11-10(14-7-15-11)12(18)16-8-3-5-9(6-4-8)17(20)21/h3-7H,2H2,1H3,(H,14,15)(H,16,18)
InChIKey
KREPWCAHIBLEAU-UHFFFAOYSA-N
Synonyms
313251-33-1
313251331
5(4NITROPHENYLCARBAMOYL)3HIMIDAZOLE4CARBOXYLICACIDETHYLESTER
CCOC(=O)c1(nH)cnc1C(=O)Nc1ccc(cc1)(N+)(=O)(O)
CCOC(=O)C1=C(N=CN1)C(=O)NC2=CC=C(C=C2)(N+)(=O)(O)
ETHYL4((4NITROANILINO)CARBONYL)1HIMIDAZOLE5CARBOXYLATE
ethyl4((4nitrophenyl)carbamoyl)1Himidazole5carboxylate
InChI=1SC13H12N4O5c122213(19)1110(1471511)12(18)168359(648)17(20)21h37H2H21H3(H1415)(H1618)
MFCD01840933
ZINC000006783904
ZINC06783904
ZINC6783904

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Available files

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