basic_info |
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| Product_Name: | 3-[3-(AMINOIMINOMETHYL)PHENYL]-5-[[[4-(AMINOIMINOMETHYL)PHENYL]AMINO]CARBONYL]-4,5-DIHYDRO-5-ISOXAZOLEACETIC ACID METHYL ESTER |
| CAS: | 193003-92-8 |
| EnglishSynonyms: | 5-ISOXAZOLEACETIC ACID, 3-[3-(AMINOIMINOMETHYL)PHENYL]-5-[[[4-(AMINOIMINOMETHYL)PHENYL]AMINO]CARBONYL]-4,5-DIHYDRO-, METHYL ESTER ; 3-[3-(AMINOIMINOMETHYL)PHENYL]-5-[[[4-(AMINOIMINOMETHYL)PHENYL]AMINO]CARBONYL]-4,5-DIHYDRO-5-ISOXAZOLEACETIC ACID METHYL ESTER |
| pro_mdlNumber: | MFCD18206862 |
| pro_acceptors: | 10 |
| pro_donors: | 3 |
| pro_smile: | COC(=O)CC1(CC(=NO1)c2cccc(c2)/C=N/N)C(=O)Nc3ccc(cc3)/C=N/N |
| InChi: | InChI=1S/C21H22N6O4/c1-30-19(28)11-21(20(29)26-17-7-5-14(6-8-17)12-24-22)10-18(27-31-21)16-4-2-3-15(9-16)13-25-23/h2-9,12-13H,10-11,22-23H2,1H3,(H,26,29)/b24-12+,25-13+ |
| InChiKey: | InChIKey=CSHSYLVXXXYULC-DWGHPKEWSA-N |
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