Basic Information |
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Product Name: | DISODIUM 1-AMINO-4-[[3-[(5-CHLORO-2,6-DIFLUORO-4-PYRIMIDINYL)AMINO]-2-METHYL-5-SULPHONATOPHENYL]AMINO]-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-SULPHONATE |
CAS: | 72139-17-4 |
English Synonyms: | DISODIUM 1-AMINO-4-[[3-[(5-CHLORO-2,6-DIFLUORO-4-PYRIMIDINYL)AMINO]-2-METHYL-5-SULPHONATOPHENYL]AMINO]-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-SULPHONATE |
MDL Number.: | MFCD23142861 |
H bond acceptor: | 13 |
H bond donor: | 3 |
Smile: | Cc1c(cc(cc1Nc2c(c(nc(n2)F)F)Cl)S(=O)(=O)[O-])Nc3cc(c(c4c3C(=O)c5ccccc5C4=O)N)S(=O)(=O)[O-].[Na+].[Na+] |
InChi: | InChI=1S/C25H16ClF2N5O8S2.2Na/c1-9-13(6-10(42(36,37)38)7-14(9)31-24-19(26)23(27)32-25(28)33-24)30-15-8-16(43(39,40)41)20(29)18-17(15)21(34)11-4-2-3-5-12(11)22(18)35;;/h2-8,30H,29H2,1H3,(H,31,32,33)(H,36,37,38)(H,39,40,41);;/q;2*+1/p-2 |
InChiKey: | InChIKey=ZNJIJUTZYLARBY-UHFFFAOYSA-L |
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