Vitas-M small molecule compound
(1S,2R)-2-({2-[(4-chloro-3,5-dimethylphenoxy)acetyl]hydrazinyl}carbonyl)cyclohexanecarboxylic acid
Catalog ID
STK413369
SMILES O=C(COc1cc(C)c(c(c1)C)Cl)NNC(=O)[C@@H]1CCCC[C@@H]1C(=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 C18H23ClN2O5 MW 382.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23ClN2O5/c1-10-7-12(8-11(2)16(10)19)26-9-15(22)20-21-17(23)13-5-3-4-6-14(13)18(24)25/h7-8,13-14H,3-6,9H2,1-2H3,(H,20,22)(H,21,23)(H,24,25)/t13-,14+/m1/s1InChIKey
ZSJPUFWHNBMYRG-KGLIPLIRSA-NSynonyms
(1S2R)2(((2(4CHLORO35DIMETHYLPHENOXY)ACETYL)AMINO)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
(1S2R)2((2((4chloro35dimethylphenoxy)acetyl)hydrazinyl)carbonyl)cyclohexanecarboxylicacid
CC1=CC(=CC(=C1Cl)C)OCC(=O)NNC(=O)C2CCCCC2C(=O)O
InChI=1SC18H23ClN2O5c110712(811(2)16(10)19)26915(22)202117(23)13534614(13)18(24)25h781314H369H212H3(H2022)(H2123)(H2425)t1314+m1s1
MFCD13368875
O=C(COc1cc(C)c(c(c1)C)Cl)NNC(=O)(C@@H)1CCCC(C@@H)1C(=O)O
ZINC000000941973
ZINC941973
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