Search Result : Detailed Informations
| Structure |
Other Information |
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| Canonical SMILES |
COC1=CC(=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC4=C(C(=NC(=N4)F)F)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]
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| Iso SMILES |
COC1=CC(=C(C=C1)N/N=C2/C(=CC3=C(C2=O)C=CC(=C3)NC4=C(C(=NC(=N4)F)F)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]
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| InChI |
InChI=1S/C21H14ClF2N5O8S2.2Na/c1-37-11-3-5-13(14(8-11)38(31,32)33)28-29-17-15(39(34,35)36)7-9-6-10(2-4-12(9)18(17)30)25-20-16(22)19(23)26-21(24)27-20;;/h2-8,28H,1H3,(H,25,26,27)(H,31,32,33)(H,34,35,36);;/q;2*+1/p-2/b29-17-;;
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| InChI Key |
QFKARGTXAOBDSD-ULBWHOMYSA-L
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| Formula |
C21H12ClF2N5Na2O8S2
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| Mol Weight |
645.908 |
| XlogP3 |
0 |
| Charge |
0 |
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Click structure image, you can go to pubchem link...
| Synonyms Information |
| CAS Name |
disodium (3E)-7-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]-3-[(4-methoxy-2-sulfonatophenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonate |
| IUPAC Name |
disodium (3E)-7-[(5-chloro-2,6-difluoro-pyrimidin-4-yl)amino]-3-[(4-methoxy-2-sulfonato-phenyl)hydrazono]-4-oxo-naphthalene-2-sulfonate |
| Openeye Name |
disodium (3E)-7-[(5-chloro-2,6-difluoropyrimidin-4-yl)amino]-3-[(4-methoxy-2-sulfonatophenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonate |
| Systematic Name |
disodium (3E)-7-[[5-chloranyl-2,6-bis(fluoranyl)pyrimidin-4-yl]amino]-3-[(4-methoxy-2-sulfonato-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate |
| Tratitional Name |
disodium (3E)-7-[[5-chloranyl-2,6-bis(fluoranyl)pyrimidin-4-yl]amino]-3-[(4-methoxy-2-sulfonato-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate |
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