basic_info |
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| Product_Name: | 5-((3,4-DICHLOROANILINO)METHYL)-4-PHENYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE |
| CAS: | 539811-22-8 |
| EnglishSynonyms: | 5-((3,4-DICHLOROANILINO)METHYL)-4-PHENYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE |
| pro_mdlNumber: | MFCD05154910 |
| pro_acceptors: | 4 |
| pro_donors: | 2 |
| pro_smile: | c1ccc(cc1)n2c(n[nH]c2=S)CNc3ccc(c(c3)Cl)Cl |
| InChi: | InChI=1S/C15H12Cl2N4S/c16-12-7-6-10(8-13(12)17)18-9-14-19-20-15(22)21(14)11-4-2-1-3-5-11/h1-8,18H,9H2,(H,20,22) |
| InChiKey: | InChIKey=XSPFUUGBCGSSHB-UHFFFAOYSA-N |
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