Basic Information |
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Product Name: | TRISODIUM 4-[[5-[[(2,3-DICHLORO-6-QUINOXALINYL)CARBONYL]AMINO]-2-SULPHONATOPHENYL]AZO]-4,5-DIHYDRO-1-(2-METHYL-4-SULPHONATOPHENYL)-5-OXO-1H-PYRAZOLE-3-CARBOXYLATE |
CAS: | 72139-14-1 |
English Synonyms: | TRISODIUM 4-[[5-[[(2,3-DICHLORO-6-QUINOXALINYL)CARBONYL]AMINO]-2-SULPHONATOPHENYL]AZO]-4,5-DIHYDRO-1-(2-METHYL-4-SULPHONATOPHENYL)-5-OXO-1H-PYRAZOLE-3-CARBOXYLATE |
MDL Number.: | MFCD23142860 |
H bond acceptor: | 17 |
H bond donor: | 1 |
Smile: | Cc1cc(ccc1N2C(=O)C(C(=N2)C(=O)[O-])/N=N/c3cc(ccc3S(=O)(=O)[O-])NC(=O)c4ccc5c(c4)nc(c(n5)Cl)Cl)S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
InChi: | InChI=1S/C26H17Cl2N7O10S2.3Na/c1-11-8-14(46(40,41)42)4-6-18(11)35-25(37)20(21(34-35)26(38)39)33-32-17-10-13(3-7-19(17)47(43,44)45)29-24(36)12-2-5-15-16(9-12)31-23(28)22(27)30-15;;;/h2-10,20H,1H3,(H,29,36)(H,38,39)(H,40,41,42)(H,43,44,45);;;/q;3*+1/p-3/b33-32+;;; |
InChiKey: | InChIKey=QVDFDCWLEKWNMS-KGMXHPFTSA-K |
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