basic_info |
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| Product_Name: | 3-((4-[(E)-(2-CHLORO-5-([(4-METHYLPHENYL)SULFONYL]AMINO)PHENYL)DIAZENYL]-1-HYDROXY-2-NAPHTHOYL)AMINO)-4-[METHYL(OCTADECYL)AMINO]BENZENESULFONIC ACID |
| CAS: | 478250-29-2 |
| EnglishSynonyms: | 3-((4-[(E)-(2-CHLORO-5-([(4-METHYLPHENYL)SULFONYL]AMINO)PHENYL)DIAZENYL]-1-HYDROXY-2-NAPHTHOYL)AMINO)-4-[METHYL(OCTADECYL)AMINO]BENZENESULFONIC ACID |
| pro_mdlNumber: | MFCD02916295 |
| pro_acceptors: | 12 |
| pro_donors: | 4 |
| pro_smile: | CCCCCCCCCCCCCCCCCCN(C)c1ccc(cc1NC(=O)c2cc(c3ccccc3c2O)/N=N/c4cc(ccc4Cl)NS(=O)(=O)c5ccc(cc5)C)S(=O)(=O)O |
| InChi: | InChI=1S/C49H62ClN5O7S2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-32-55(3)47-31-29-39(64(60,61)62)34-46(47)51-49(57)42-35-44(40-22-19-20-23-41(40)48(42)56)52-53-45-33-37(26-30-43(45)50)54-63(58,59)38-27-24-36(2)25-28-38/h19-20,22-31,33-35,54,56H,4-18,21,32H2,1-3H3,(H,51,57)(H,60,61,62)/b53-52+ |
| InChiKey: | InChIKey=GACNLHAZOVSTCC-KNPAHQFXSA-N |
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