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basic_info |
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Product_Name: | IKK-3 INHIBITOR |
CAS: | 862812-98-4 |
EnglishSynonyms: | 5-(5,6-DIMETHOXY-1H-BENZIMIDAZOL-1-YL)-3-([2-(METHYLSULFONYL)BENZYL]OXY)THIOPHENE-2-CARBONITRILE ; 2-THIOPHENECARBONITRILE, 5-(5,6-DIMETHOXY-1H-BENZIMIDAZOL-1-YL)-3-[[2-(METHYLSULFONYL)PHENYL]METHOXY]- ; IKK-3 INHIBITOR ; 5-(5,6-DIMETHOXY-1H-BENZIMIDAZOL-1-YL)-3-[[2-(METHYLSULFONYL)PHENYL]METHOXY]-2-THIOPHENECARBONITRILE |
pro_mdlNumber: | MFCD10567700 |
pro_acceptors: | 8 |
pro_donors: | 0 |
pro_smile: | COc1cc2c(cc1OC)n(cn2)c3cc(c(s3)C#N)OCc4ccccc4S(=O)(=O)C |
InChi: | InChI=1S/C22H19N3O5S2/c1-28-17-8-15-16(9-18(17)29-2)25(13-24-15)22-10-19(20(11-23)31-22)30-12-14-6-4-5-7-21(14)32(3,26)27/h4-10,13H,12H2,1-3H3 |
InChiKey: | InChIKey=LDTAHRLHGHFHKP-UHFFFAOYSA-N |
* If the product has intellectual property rights, a license granted is must or contact us.