Vitas-M small molecule compound
(1R,2S)-2-({4-[(3,5-dimethylphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexanecarboxylic acid
Catalog ID
STK096871
SMILES Cc1cc(C)cc(c1)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 C22H26N2O5S MW 430.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O5S/c1-14-11-15(2)13-17(12-14)24-30(28,29)18-9-7-16(8-10-18)23-21(25)19-5-3-4-6-20(19)22(26)27/h7-13,19-20,24H,3-6H2,1-2H3,(H,23,25)(H,26,27)/t19-,20+/m0/s1InChIKey
BADFKMASZGUKLB-VQTJNVASSA-NSynonyms
(1R2S)2((4((35DIMETHYLPHENYL)SULFAMOYL)PHENYL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
(1R2S)2((4((35DIMETHYLPHENYL)SULFAMOYL)PHENYL)CARBAMOYL)CYCLOHEXANECARBOXYLICACID
CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3C(=O)O)C
Cc1cc(C)cc(c1)NS(=O)(=O)c1ccc(cc1)NC(=O)(C@H)1CCCC(C@H)1C(=O)O
InChI=1SC22H26N2O5Sc1141115(2)1317(1214)2430(2829)189716(81018)2321(25)19534620(19)22(26)27h713192024H36H212H3(H2325)(H2627)t1920+m0s1
MFCD13368399
STK096871
ZINC000006029242
ZINC6029242
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