basic_info |
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| Product_Name: | 1-PIPERAZINEETHANOL, 4-(10,11-DIHYDRO-8-(METHYLTHIO)DIBENZO(B,F)THIEPI N-10-YL)-ALPHA-ETHYL-, MONOMETHANESULFONATE |
| CAS: | 86499-12-9 |
| EnglishSynonyms: | 1-PIPERAZINEETHANOL, 4-(10,11-DIHYDRO-8-(METHYLTHIO)DIBENZO(B,F)THIEPI N-10-YL)-ALPHA-ETHYL-, MONOMETHANESULFONATE |
| pro_mdlNumber: | MFCD01702751 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | CCC(CN1CCN(CC1)C2Cc3ccccc3Sc4c2cc(cc4)SC)O.CS(=O)(=O)O |
| InChi: | InChI=1S/C23H30N2OS2.CH4O3S/c1-3-18(26)16-24-10-12-25(13-11-24)21-14-17-6-4-5-7-22(17)28-23-9-8-19(27-2)15-20(21)23;1-5(2,3)4/h4-9,15,18,21,26H,3,10-14,16H2,1-2H3;1H3,(H,2,3,4) |
| InChiKey: | InChIKey=PFCCCRDDVVAFHF-UHFFFAOYSA-N |
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