ZPU

4-propan-2-yl-~{N}-pyridin-2-yl-benzamide

Created:	2023-06-29
Last modified:	2024-01-31

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1 entries where ZPU is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	0
Bond Count	35
Aromatic Bond Count	12

2D diagram of ZPU

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Chemical Component Summary
Name	4-propan-2-yl-~{N}-pyridin-2-yl-benzamide
Systematic Name (OpenEye OEToolkits)	4-propan-2-yl-~{N}-pyridin-2-yl-benzamide
Formula	C₁₅ H₁₆ N₂ O
Molecular Weight	240.3
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CC(C)c1ccc(cc1)C(=O)Nc2ccccn2
SMILES	OpenEye OEToolkits	2.0.7	CC(C)c1ccc(cc1)C(=O)Nc2ccccn2
Canonical SMILES	CACTVS	3.385	CC(C)c1ccc(cc1)C(=O)Nc2ccccn2
Canonical SMILES	OpenEye OEToolkits	2.0.7	CC(C)c1ccc(cc1)C(=O)Nc2ccccn2
InChI	InChI	1.06	InChI=1S/C15H16N2O/c1-11(2)12-6-8-13(9-7-12)15(18)17-14-5-3-4-10-16-14/h3-11H,1-2H3,(H,16,17,18)
InChIKey	InChI	1.06	SDOPJFVCPDSIDQ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	898760
ChEMBL	CHEMBL4574610

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.