Pro_Molecular_Structure:
pro_cdbregno:CCD00318359
ETHYL 4-(3-BROMO-5-ETHOXY-4-METHOXYPHENYL)-6-PHENYL-2-THIOXO-1,2,3,4-TETRAHYDRO-5-PYRIMIDINECARBOXYLATE
pro_formula:C22 H23 Br N2 O4 S
pro_molWeight:491.404
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| Product_Name： | ETHYL 4-(3-BROMO-5-ETHOXY-4-METHOXYPHENYL)-6-PHENYL-2-THIOXO-1,2,3,4-TETRAHYDRO-5-PYRIMIDINECARBOXYLATE |
| EnglishSynonyms： | ETHYL 4-(3-BROMO-5-ETHOXY-4-METHOXYPHENYL)-6-PHENYL-2-THIOXO-1,2,3,4-TETRAHYDRO-5-PYRIMIDINECARBOXYLATE |
| pro_mdlNumber： | MFCD02376515 |
| pro_acceptors： | 6 |
| pro_donors： | 2 |
| pro_smile： | CCOc1cc(cc(c1OC)Br)C2C(=C(NC(=S)N2)c3ccccc3)C(=O)OCC |
| InChi： | InChI=1S/C22H23BrN2O4S/c1-4-28-16-12-14(11-15(23)20(16)27-3)19-17(21(26)29-5-2)18(24-22(30)25-19)13-9-7-6-8-10-13/h6-12,19H,4-5H2,1-3H3,(H2,24,25,30) |
| InChiKey： | InChIKey=XZWBYATYBZHATB-UHFFFAOYSA-N |
basic_info
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