basic_info |
|
| Product_Name: | OTAVA-FLUOR OTVD_0361 |
| EnglishSynonyms: | OTAVA-FLUOR OTVD_0361 |
| pro_mdlNumber: | MFCD10001304 |
| pro_acceptors: | 4 |
| pro_donors: | 0 |
| pro_smile: | Cc1ccc(cc1)c2csc3c2c(=O)n4c([n+]3C)/C(=C/c5ccc(cc5)N(C)C)/CC4.[I-] |
| InChi: | InChI=1S/C26H26N3OS.HI/c1-17-5-9-19(10-6-17)22-16-31-26-23(22)25(30)29-14-13-20(24(29)28(26)4)15-18-7-11-21(12-8-18)27(2)3;/h5-12,15-16H,13-14H2,1-4H3;1H/q+1;/p-1 |
| InChiKey: | InChIKey=ZGOXRPXDRNIHQK-UHFFFAOYSA-M |
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