KM8

~{N}-[3-(5-carbamimidoylthiophen-3-yl)phenyl]propanamide

Created:	2019-06-07
Last modified:	2024-09-27

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3 entries where KM8 is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	0
Bond Count	35
Aromatic Bond Count	11

2D diagram of KM8

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Chemical Component Summary
Name	~{N}-[3-(5-carbamimidoylthiophen-3-yl)phenyl]propanamide
Systematic Name (OpenEye OEToolkits)	~{N}-[3-(5-carbamimidoylthiophen-3-yl)phenyl]propanamide
Formula	C₁₄ H₁₅ N₃ O S
Molecular Weight	273.353
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCC(=O)Nc1cccc(c1)c2csc(c2)C(N)=N
SMILES	OpenEye OEToolkits	2.0.7	CCC(=O)Nc1cccc(c1)c2cc(sc2)C(=N)N
Canonical SMILES	CACTVS	3.385	CCC(=O)Nc1cccc(c1)c2csc(c2)C(N)=N
Canonical SMILES	OpenEye OEToolkits	2.0.7	[H]/N=C(\c1cc(cs1)c2cccc(c2)NC(=O)CC)/N
InChI	InChI	1.03	InChI=1S/C14H15N3OS/c1-2-13(18)17-11-5-3-4-9(6-11)10-7-12(14(15)16)19-8-10/h3-8H,2H2,1H3,(H3,15,16)(H,17,18)
InChIKey	InChI	1.03	GPXOTALYBUCFOP-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	146672925

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