Basic Information |
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| Product Name： | E-4031 |
| CAS： | 113558-89-7 ;113559-13-0 |
| English Synonyms： | E-4031 |
| MDL Number.： | MFCD00889193 |
| H bond acceptor： | 6 |
| H bond donor： | 1 |
| Smile： | Cc1cccc(n1)CCN2CCC(CC2)C(=O)c3ccc(cc3)NS(=O)(=O)C.O.O.Cl.Cl |
| InChi： | InChI=1S/C21H27N3O3S.2ClH.2H2O/c1-16-4-3-5-19(22-16)12-15-24-13-10-18(11-14-24)21(25)17-6-8-20(9-7-17)23-28(2,26)27;;;;/h3-9,18,23H,10-15H2,1-2H3;2*1H;2*1H2 |
| InChiKey： | InChIKey=AJNFQUKPBCGJKX-UHFFFAOYSA-N |
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