basic_info |
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| Product_Name: | PIPERONAL 4,4'-(1,4-PIPERAZINEDIYL)BIS(3-THIOSEMICARBAZONE) |
| CAS: | 102259-60-9 |
| EnglishSynonyms: | PIPERONAL 4,4'-(1,4-PIPERAZINEDIYL)BIS(3-THIOSEMICARBAZONE) |
| pro_mdlNumber: | MFCD01699250 |
| pro_acceptors: | 12 |
| pro_donors: | 4 |
| pro_smile: | c1cc2c(cc1/C=N/NC(=S)N)OC(O2)N3CCN(CC3)C4Oc5ccc(cc5O4)/C=N/NC(=S)N |
| InChi: | InChI=1S/C22H24N8O4S2/c23-19(35)27-25-11-13-1-3-15-17(9-13)33-21(31-15)29-5-7-30(8-6-29)22-32-16-4-2-14(10-18(16)34-22)12-26-28-20(24)36/h1-4,9-12,21-22H,5-8H2,(H3,23,27,35)(H3,24,28,36)/b25-11+,26-12+ |
| InChiKey: | InChIKey=URMSIXBAOPHLGW-KOZSXFMUSA-N |
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