JFP

N-(4-methyl-1,3-thiazol-2-yl)propanamide

Created:	2018-09-10
Last modified:	2018-10-10

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8 entries where JFP is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	21
Chiral Atom Count	0
Bond Count	21
Aromatic Bond Count	5

2D diagram of JFP

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Chemical Component Summary
Name	N-(4-methyl-1,3-thiazol-2-yl)propanamide
Systematic Name (OpenEye OEToolkits)	~{N}-(4-methyl-1,3-thiazol-2-yl)propanamide
Formula	C₇ H₁₀ N₂ O S
Molecular Weight	170.232
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	CCC(=O)Nc1nc(cs1)C
SMILES	CACTVS	3.385	CCC(=O)Nc1scc(C)n1
SMILES	OpenEye OEToolkits	2.0.6	CCC(=O)Nc1nc(cs1)C
Canonical SMILES	CACTVS	3.385	CCC(=O)Nc1scc(C)n1
Canonical SMILES	OpenEye OEToolkits	2.0.6	CCC(=O)Nc1nc(cs1)C
InChI	InChI	1.03	InChI=1S/C7H10N2OS/c1-3-6(10)9-7-8-5(2)4-11-7/h4H,3H2,1-2H3,(H,8,9,10)
InChIKey	InChI	1.03	AIOZNYOAFODHNA-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	3613666
ChEMBL	CHEMBL4096653

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