Vitas-M small molecule compound
6-{[1-(2,6-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK420238
SMILES O=C(C1CC=CCC1C(=O)O)Nc1c(C)nn(c1C)Cc1c(Cl)cccc1Cl
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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 C20H21Cl2N3O3 MW 422.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2N3O3/c1-11-18(23-19(26)13-6-3-4-7-14(13)20(27)28)12(2)25(24-11)10-15-16(21)8-5-9-17(15)22/h3-5,8-9,13-14H,6-7,10H2,1-2H3,(H,23,26)(H,27,28)InChIKey
VXODYQDSLYFXKR-UHFFFAOYSA-NSynonyms
490031-30-6490031306
6((1((26DICHLOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6((1(26dichlorobenzyl)35dimethyl1Hpyrazol4yl)carbamoyl)cyclohex3ene1carboxylicacid
CC1=C(C(=NN1CC2=C(C=CC=C2Cl)Cl)C)NC(=O)C3CC=CCC3C(=O)O
InChI=1SC20H21Cl2N3O3c11118(2319(26)13634714(13)20(27)28)12(2)25(2411)101516(21)85917(15)22h35891314H6710H212H3(H2326)(H2728)
MFCD03071077
ZINC000002761377
ZINC000002761380
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