Vitas-M small molecule compound
2-({2-[(2-bromo-4-tert-butylphenoxy)acetyl]hydrazinyl}carbonyl)cyclohexanecarboxylic acid
Catalog ID
STL063054
SMILES O=C(COc1ccc(cc1Br)C(C)(C)C)NNC(=O)C1CCCCC1C(=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 C20H27BrN2O5 MW 455.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27BrN2O5/c1-20(2,3)12-8-9-16(15(21)10-12)28-11-17(24)22-23-18(25)13-6-4-5-7-14(13)19(26)27/h8-10,13-14H,4-7,11H2,1-3H3,(H,22,24)(H,23,25)(H,26,27)InChIKey
KESRWHPSMPVLPK-UHFFFAOYSA-NSynonyms
671795-42-92(((2(2BROMO4TERTBUTYLPHENOXY)ACETYL)AMINO)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
2((2((2BROMO4TERTBUTYLPHENOXY)ACETYL)HYDRAZINO)CARBONYL)CYCLOHEXANECARBOXYLICACID
2((2((2bromo4tertbutylphenoxy)acetyl)hydrazinyl)carbonyl)cyclohexanecarboxylicacid
671795429
CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=O)C2CCCCC2C(=O)O)Br
InChI=1SC20H27BrN2O5c120(23)128916(15(21)1012)281117(24)222318(25)13645714(13)19(26)27h8101314H4711H213H3(H2224)(H2325)(H2627)
MFCD03921446
ZINC000012289882
ZINC000012289892
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