JJB
N-(benzylsulfonyl)-4-propoxy-3-({[4-(pyrimidin-2-yl)benzoyl]amino}methyl)benzamide
Find entries where: JJB
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | N-(benzylsulfonyl)-4-propoxy-3-({[4-(pyrimidin-2-yl)benzoyl]amino}methyl)benzamide |
Identifiers | N-(phenylmethyl)sulfonyl-4-propoxy-3-[[(4-pyrimidin-2-ylphenyl)carbonylamino]methyl]benzamide |
Formula | C29 H28 N4 O5 S |
Molecular Weight | 544.621 |
Type | NON-POLYMER |
Isomeric SMILES | CCCOc1ccc(cc1CNC(=O)c2ccc(cc2)c3ncccn3)C(=O)NS(=O)(=O)Cc4ccccc4 |
InChI | InChI=1S/C29H28N4O5S/c1-2-17-38-26-14-13-24(29(35)33-39(36,37)20-21-7-4-3-5-8-21)18-25(26)19-32-28(34)23-11-9-22(10-12-23)27-30-15-6-16-31-27/h3-16,18H,2,17,19-20H2,1H3,(H,32,34)(H,33,35) |
InChIKey | JNDTXHSMALXHGN-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 67 |
Chiral Atom Count | 0 |
Bond Count | 70 |
Aromatic Bond Count | 24 |
Related Resource References
Resource Name | Reference |
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PubChem | 118704890 |
ChEMBL | CHEMBL3589241 |