Vitas-M small molecule compound
6-({4-[(3,5-dichlorophenyl)sulfamoyl]phenyl}carbamoyl)-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Catalog ID
STK466932
SMILES O=C(C1CC(=C(CC1C(=O)O)C)C)Nc1ccc(cc1)S(=O)(=O)Nc1cc(Cl)cc(c1)Cl
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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 C22H22Cl2N2O5S MW 497.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N2O5S/c1-12-7-19(20(22(28)29)8-13(12)2)21(27)25-16-3-5-18(6-4-16)32(30,31)26-17-10-14(23)9-15(24)11-17/h3-6,9-11,19-20,26H,7-8H2,1-2H3,(H,25,27)(H,28,29)InChIKey
SXQHYQCTRYBHOT-UHFFFAOYSA-NSynonyms
6((4((35dichlorophenyl)sulfamoyl)phenyl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(N(4(((35DICHLOROPHENYL)AMINO)SULFONYL)PHENYL)CARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)Cl)Cl)C(=O)O)C
InChI=1SC22H22Cl2N2O5Sc112719(20(22(28)29)813(12)2)21(27)25163518(6416)32(3031)26171014(23)915(24)1117h36911192026H78H212H3(H2527)(H2829)
MFCD06064111
ZINC000020568956
ZINC000020568960
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