Pro_Molecular_Structure:
pro_cdbregno:CCD04234091
ZERENEX E/1101835
pro_formula:C22 H25 Cl N4 O2 S
pro_molWeight:444.984
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| Product_Name： | ZERENEX E/1101835 |
| EnglishSynonyms： | ZERENEX E/1101835 |
| pro_mdlNumber： | MFCD18480959 |
| pro_acceptors： | 6 |
| pro_donors： | 2 |
| pro_smile： | Cc1cc(c(c(c1)Cl)OCC(=O)Nc2c(cc3c(c2C)sc(n3)NN=C(C)C)C)C |
| InChi： | InChI=1S/C22H25ClN4O2S/c1-11(2)26-27-22-24-17-9-13(4)19(15(6)21(17)30-22)25-18(28)10-29-20-14(5)7-12(3)8-16(20)23/h7-9H,10H2,1-6H3,(H,24,27)(H,25,28) |
| InChiKey： | InChIKey=IUWCTRGFIZDLGQ-UHFFFAOYSA-N |
basic_info
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