basic_info |
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| Product_Name: | MDBACEC |
| CAS: | 708247-85-2 |
| EnglishSynonyms: | METHYL 2-(([(5,6-DIMETHYL-1,3-BENZOTHIAZOL-2-YL)AMINO]CARBONOTHIOYL)AMINO)-5-ETHYL-3-THIOPHENECARBOXYLATE ; MDBACEC |
| pro_mdlNumber: | MFCD04137108 |
| pro_acceptors: | 5 |
| pro_donors: | 2 |
| pro_smile: | CCc1cc(c(s1)NC(=S)Nc2nc3cc(c(cc3s2)C)C)C(=O)OC |
| InChi: | InChI=1S/C18H19N3O2S3/c1-5-11-8-12(16(22)23-4)15(25-11)20-17(24)21-18-19-13-6-9(2)10(3)7-14(13)26-18/h6-8H,5H2,1-4H3,(H2,19,20,21,24) |
| InChiKey: | InChIKey=MEHDOPNGFJIDKR-UHFFFAOYSA-N |
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