Vitas-M small molecule compound

(1R,2S)-2-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexanecarboxylic acid

Catalog ID
STK060286
SMILES COc1ccc(cc1)NS(=O)(=O)c1ccc(cc1)NC(=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 C21H24N2O6S MW 432.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O6S/c1-29-16-10-6-15(7-11-16)23-30(27,28)17-12-8-14(9-13-17)22-20(24)18-4-2-3-5-19(18)21(25)26/h6-13,18-19,23H,2-5H2,1H3,(H,22,24)(H,25,26)/t18-,19+/m0/s1
InChIKey
IHZNEGNAWUEPCJ-RBUKOAKNSA-N
Synonyms

(1R2S)2((4((4METHOXYPHENYL)SULFAMOYL)PHENYL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
(1R2S)2((4((4METHOXYPHENYL)SULFAMOYL)PHENYL)CARBAMOYL)CYCLOHEXANECARBOXYLICACID
COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3C(=O)O
COc1ccc(cc1)NS(=O)(=O)c1ccc(cc1)NC(=O)(C@H)1CCCC(C@H)1C(=O)O
InChI=1SC21H24N2O6Sc1291610615(71116)2330(2728)1712814(91317)2220(24)18423519(18)21(25)26h613181923H25H21H3(H2224)(H2526)t1819+m0s1
MFCD13368355
STK060286
ZINC000000675187
ZINC675187

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Available files

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