2-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]-6-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphophenyl)-1H-
Get a Quick Quote Now
Select Packaging
Product Description
Product
2-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]-6-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphophenyl)-1H-
CAS
83400-22-0
Formula
C21H14ClF2N7Na2O7S2; C21H16ClF2N7O7S2.xNa
Typical Product Specifications
Molecular weight
659.94
EINECS
280-438-9
SMILES
Cc1c(cc(cc1/N=N/C2C(=NN(C2=O)c3ccc(cc3)S(=O)(=O)[O-])C)S(=O)(=O)[O-])Nc4c(c(nc(n4)F)F)Cl.[Na+].[Na+]
InChI
IJCMZANLDDGSKI-NTDCDQSISA-L
InChIKey
1S/C21H16ClF2N7O7S2.2Na/c1-9-14(25-19-16(22)18(23)26-21(24)27-19)7-13(40(36,37)38)8-15(9)28-29-17-10(2)30-31(20(17)32)11-3-5-12(6-4-11)39(33,34)35;;/h3-8,17H,1-2H3,(H,25,26,27)(H,33,34,35)(H,36,37,38);;/q;2*+1/p-2/b29-28+;;
Class
2-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]-6-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphophenyl)-1H-
Product Description
Product
2-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]-6-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphophenyl)-1H-
CAS
83400-22-0
Formula
C21H14ClF2N7Na2O7S2; C21H16ClF2N7O7S2.xNa
Typical Product Specifications
Molecular weight
659.94
EINECS
280-438-9
SMILES
Cc1c(cc(cc1/N=N/C2C(=NN(C2=O)c3ccc(cc3)S(=O)(=O)[O-])C)S(=O)(=O)[O-])Nc4c(c(nc(n4)F)F)Cl.[Na+].[Na+]
InChI
IJCMZANLDDGSKI-NTDCDQSISA-L
InChIKey
1S/C21H16ClF2N7O7S2.2Na/c1-9-14(25-19-16(22)18(23)26-21(24)27-19)7-13(40(36,37)38)8-15(9)28-29-17-10(2)30-31(20(17)32)11-3-5-12(6-4-11)39(33,34)35;;/h3-8,17H,1-2H3,(H,25,26,27)(H,33,34,35)(H,36,37,38);;/q;2*+1/p-2/b29-28+;;
Class
