Vitas-M small molecule compound

6-({2-[(5-bromofuran-2-yl)carbonyl]hydrazinyl}carbonyl)cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK425486
SMILES Brc1ccc(o1)C(=O)NNC(=O)C1CC=CCC1C(=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 C13H13BrN2O5 MW 357.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13BrN2O5/c14-10-6-5-9(21-10)12(18)16-15-11(17)7-3-1-2-4-8(7)13(19)20/h1-2,5-8H,3-4H2,(H,15,17)(H,16,18)(H,19,20)
InChIKey
BSTGYVZGQCXXRZ-UHFFFAOYSA-N
Synonyms

(1R6R)6((2((5BROMOFURAN2YL)CARBONYL)HYDRAZINYL)CARBONYL)CYCLOHEX3ENE1CARBOXYLICACID
(1R6S)6((2((5BROMOFURAN2YL)CARBONYL)HYDRAZINYL)CARBONYL)CYCLOHEX3ENE1CARBOXYLICACID
(1S6R)6((2((5BROMOFURAN2YL)CARBONYL)HYDRAZINYL)CARBONYL)CYCLOHEX3ENE1CARBOXYLICACID
6(((5BROMOFURAN2CARBONYL)AMINO)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6((2((5BROMOFURAN2YL)CARBONYL)HYDRAZINO)CARBONYL)CYCLOHEX3ENE1CARBOXYLICACID
6((2((5bromofuran2yl)carbonyl)hydrazinyl)carbonyl)cyclohex3ene1carboxylicacid
6(N((5BROMO2FURYL)CARBONYLAMINO)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
C1C=CCC(C1C(=O)NNC(=O)C2=CC=C(O2)Br)C(=O)O
InChI=1SC13H13BrN2O5c1410659(2110)12(18)161511(17)731248(7)13(19)20h1258H34H2(H1517)(H1618)(H1920)
MFCD02375110
ZINC000004473855
ZINC000004651769

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Available files

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