KU0
2-[(2S)-1-(3,5-dichloropyridine-4-carbonyl)pyrrolidin-2-yl]-5-hydroxy-6-oxo-N-[2-(phenylsulfonyl)ethyl]-1,6-dihydropyrimidine-4-carboxamide
Find entries where: KU0
is present as a standalone ligand in 2 entries
Chemical Component Summary | |
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Name | 2-[(2S)-1-(3,5-dichloropyridine-4-carbonyl)pyrrolidin-2-yl]-5-hydroxy-6-oxo-N-[2-(phenylsulfonyl)ethyl]-1,6-dihydropyrimidine-4-carboxamide |
Identifiers | 2-[(2~{S})-1-[3,5-bis(chloranyl)pyridin-4-yl]carbonylpyrrolidin-2-yl]-5-oxidanyl-6-oxidanylidene-~{N}-[2-(phenylsulfonyl)ethyl]-1~{H}-pyrimidine-4-carboxamide |
Formula | C23 H21 Cl2 N5 O6 S |
Molecular Weight | 566.414 |
Type | NON-POLYMER |
Isomeric SMILES | c1ccc(cc1)S(=O)(=O)CCNC(=O)C2=C(C(=O)NC(=N2)[C@@H]3CCCN3C(=O)c4c(cncc4Cl)Cl)O |
InChI | InChI=1S/C23H21Cl2N5O6S/c24-14-11-26-12-15(25)17(14)23(34)30-9-4-7-16(30)20-28-18(19(31)22(33)29-20)21(32)27-8-10-37(35,36)13-5-2-1-3-6-13/h1-3,5-6,11-12,16,31H,4,7-10H2,(H,27,32)(H,28,29,33)/t16-/m0/s1 |
InChIKey | YFLBJSGKKSRTGS-INIZCTEOSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 58 |
Chiral Atom Count | 1 |
Bond Count | 61 |
Aromatic Bond Count | 12 |
Related Resource References
Resource Name | Reference |
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PubChem | 135567348, 131953471 |