B5P
N-{3-[5-hydroxy-8-(3-methylbutyl)-7-oxo-7,8-dihydroimidazo[1,2-a]pyrimidin-6-yl]-1,1-dioxido-4H-1,2,4-benzothiadiazin-7-yl}methanesulfonamide
Find entries where: B5P
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | N-{3-[5-hydroxy-8-(3-methylbutyl)-7-oxo-7,8-dihydroimidazo[1,2-a]pyrimidin-6-yl]-1,1-dioxido-4H-1,2,4-benzothiadiazin-7-yl}methanesulfonamide |
Identifiers | N-[3-[5-hydroxy-8-(3-methylbutyl)-7-oxo-imidazo[2,1-b]pyrimidin-6-yl]-1,1-dioxo-4H-benzo[e][1,2,4]thiadiazin-7-yl]methanesulfonamide |
Formula | C19 H22 N6 O6 S2 |
Molecular Weight | 494.545 |
Type | NON-POLYMER |
Isomeric SMILES | CC(C)CCN1c2nccn2C(=C(C1=O)C3=NS(=O)(=O)c4cc(ccc4N3)NS(=O)(=O)C)O |
InChI | InChI=1S/C19H22N6O6S2/c1-11(2)6-8-24-17(26)15(18(27)25-9-7-20-19(24)25)16-21-13-5-4-12(22-32(3,28)29)10-14(13)33(30,31)23-16/h4-5,7,9-11,22,27H,6,8H2,1-3H3,(H,21,23) |
InChIKey | HJSHQVOBZCLIRI-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 55 |
Chiral Atom Count | 0 |
Bond Count | 58 |
Aromatic Bond Count | 11 |