Basic Information |
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| Product Name: | TIANEPTINE METABOLITE MC5 SODIUM SALT |
| CAS: | 115220-11-6 |
| English Synonyms: | 7-[(3-CHLORO-6,11-DIHYDRO-6-METHYL-DIBENZO[C,F][1,2]THIAZEPIN-11-YL)AMINO]PENTANOIC ACID S,S-DIOXIDE SODIUM SALT ; PENTANOIC ACID METABOLITE ; TIANEPTINE METABOLITE MC5 SODIUM SALT ; TIANEPTINE MC5 |
| MDL Number.: | MFCD15071352 |
| H bond acceptor: | 6 |
| H bond donor: | 1 |
| Smile: | CN1c2ccccc2C(c3ccc(cc3S1(=O)=O)Cl)NCCCCC(=O)[O-].[Na+] |
| InChi: | InChI=1S/C19H21ClN2O4S.Na/c1-22-16-7-3-2-6-14(16)19(21-11-5-4-8-18(23)24)15-10-9-13(20)12-17(15)27(22,25)26;/h2-3,6-7,9-10,12,19,21H,4-5,8,11H2,1H3,(H,23,24);/q;+1/p-1 |
| InChiKey: | InChIKey=GBYSEZGRQUELJJ-UHFFFAOYSA-M |
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