YHU

~{N}-propan-2-yl-1~{H}-imidazole-4-carboxamide

Created:	2023-06-19
Last modified:	2024-01-10

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1 entries where YHU is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	22
Aromatic Bond Count	5

2D diagram of YHU

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Chemical Component Summary
Name	~{N}-propan-2-yl-1~{H}-imidazole-4-carboxamide
Systematic Name (OpenEye OEToolkits)	~{N}-propan-2-yl-1~{H}-imidazole-4-carboxamide
Formula	C₇ H₁₁ N₃ O
Molecular Weight	153.182
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CC(C)NC(=O)c1c[nH]cn1
SMILES	OpenEye OEToolkits	2.0.7	CC(C)NC(=O)c1c[nH]cn1
Canonical SMILES	CACTVS	3.385	CC(C)NC(=O)c1c[nH]cn1
Canonical SMILES	OpenEye OEToolkits	2.0.7	CC(C)NC(=O)c1c[nH]cn1
InChI	InChI	1.06	InChI=1S/C7H11N3O/c1-5(2)10-7(11)6-3-8-4-9-6/h3-5H,1-2H3,(H,8,9)(H,10,11)
InChIKey	InChI	1.06	OWYKHVLWBVIMNI-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	18976076

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.