N96

~{N}-(6,7-dihydro-4~{H}-pyrano[4,3-d][1,3]thiazol-2-yl)propanamide

Created:	2022-08-12
Last modified:	2024-09-27

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1 entries where N96 is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	0
Bond Count	27
Aromatic Bond Count	5

2D diagram of N96

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Chemical Component Summary
Name	~{N}-(6,7-dihydro-4~{H}-pyrano[4,3-d][1,3]thiazol-2-yl)propanamide
Systematic Name (OpenEye OEToolkits)	~{N}-(6,7-dihydro-4~{H}-pyrano[4,3-d][1,3]thiazol-2-yl)propanamide
Formula	C₉ H₁₂ N₂ O₂ S
Molecular Weight	212.269
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCC(=O)Nc1sc2COCCc2n1
SMILES	OpenEye OEToolkits	2.0.7	CCC(=O)Nc1nc2c(s1)COCC2
Canonical SMILES	CACTVS	3.385	CCC(=O)Nc1sc2COCCc2n1
Canonical SMILES	OpenEye OEToolkits	2.0.7	CCC(=O)Nc1nc2c(s1)COCC2
InChI	InChI	1.06	InChI=1S/C9H12N2O2S/c1-2-8(12)11-9-10-6-3-4-13-5-7(6)14-9/h2-5H2,1H3,(H,10,11,12)
InChIKey	InChI	1.06	BNOABFVSOWBPLZ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	90543536
ChEMBL	CHEMBL4522739

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