Pro_Molecular_Structure:
pro_cdbregno:CCD03257604
6-(4-BROMOPHENYLTHIO)-5-CYANO-N-((2R,4S,5R)-4-HYDROXY-5-(HYDROXYMETHYL)TETRAHYDROFURAN-2-YLCARBAMOYL)NICOTINAMIDE
pro_formula:C19 H17 Br N4 O5 S
pro_molWeight:493.336
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| Product_Name： | 6-(4-BROMOPHENYLTHIO)-5-CYANO-N-((2R,4S,5R)-4-HYDROXY-5-(HYDROXYMETHYL)TETRAHYDROFURAN-2-YLCARBAMOYL)NICOTINAMIDE |
| EnglishSynonyms： | 6-(4-BROMOPHENYLTHIO)-5-CYANO-N-((2R,4S,5R)-4-HYDROXY-5-(HYDROXYMETHYL)TETRAHYDROFURAN-2-YLCARBAMOYL)NICOTINAMIDE |
| pro_mdlNumber： | MFCD16877602 |
| pro_acceptors： | 9 |
| pro_donors： | 4 |
| pro_smile： | c1cc(ccc1Sc2c(cc(cn2)C(=O)NC(=O)N[C@H]3C[C@@H]([C@H](O3)CO)O)C#N)Br |
| InChi： | InChI=1S/C19H17BrN4O5S/c20-12-1-3-13(4-2-12)30-18-10(7-21)5-11(8-22-18)17(27)24-19(28)23-16-6-14(26)15(9-25)29-16/h1-5,8,14-16,25-26H,6,9H2,(H2,23,24,27,28)/t14-,15+,16+/m0/s1 |
| InChiKey： | InChIKey=PWHPWZNIIFKBQQ-ARFHVFGLSA-N |
basic_info
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