basic_info |
|
| Product_Name: | 4-(HEXAN-3-YL)-5-(PYRIDIN-3-YL)-4H-1,2,4-TRIAZOLE-3-THIOL |
| EnglishSynonyms: | 4-(HEXAN-3-YL)-5-(PYRIDIN-3-YL)-4H-1,2,4-TRIAZOLE-3-THIOL |
| pro_mdlNumber: | MFCD17439474 |
| pro_acceptors: | 4 |
| pro_donors: | 0 |
| pro_smile: | CCCC(CC)n1c(nnc1S)c2cccnc2 |
| InChi: | InChI=1S/C13H18N4S/c1-3-6-11(4-2)17-12(15-16-13(17)18)10-7-5-8-14-9-10/h5,7-9,11H,3-4,6H2,1-2H3,(H,16,18) |
| InChiKey: | InChIKey=XFAVOAYXURKITE-UHFFFAOYSA-N |
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