Y7F

2-methyl-~{N}-[[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)thiophen-2-yl]methyl]pyrazole-3-carboxamide

Created:	2023-11-23
Last modified:	2024-10-30

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1 entries where Y7F is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	38
Chiral Atom Count	0
Bond Count	41
Aromatic Bond Count	20

2D diagram of Y7F

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Chemical Component Summary
Name	2-methyl-~{N}-[[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)thiophen-2-yl]methyl]pyrazole-3-carboxamide
Systematic Name (OpenEye OEToolkits)	2-methyl-~{N}-[[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)thiophen-2-yl]methyl]pyrazole-3-carboxamide
Formula	C₁₆ H₁₃ N₅ O₂ S₂
Molecular Weight	371.437
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cn1nccc1C(=O)NCc2sc(cc2)c3onc(n3)c4sccc4
SMILES	OpenEye OEToolkits	2.0.7	Cn1c(ccn1)C(=O)NCc2ccc(s2)c3nc(no3)c4cccs4
Canonical SMILES	CACTVS	3.385	Cn1nccc1C(=O)NCc2sc(cc2)c3onc(n3)c4sccc4
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cn1c(ccn1)C(=O)NCc2ccc(s2)c3nc(no3)c4cccs4
InChI	InChI	1.06	InChI=1S/C16H13N5O2S2/c1-21-11(6-7-18-21)15(22)17-9-10-4-5-13(25-10)16-19-14(20-23-16)12-3-2-8-24-12/h2-8H,9H2,1H3,(H,17,22)
InChIKey	InChI	1.06	SIGJKWVCBZYUFS-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	53156137

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.