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- ChemComp-YDU: 2-cyclopentyl-N-(3-methyl-1,2,4-oxadiazol-5-yl)acetamide -

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ID or keywords:

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Basic information

EntryDatabase: PDB chemical components / ID: YDU
NameName: 2-cyclopentyl-N-(3-methyl-1,2,4-oxadiazol-5-yl)acetamide

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Chemical information

Composition
Formula: C10H15N3O2 / Number of atoms: 30 / Formula weight: 209.245 / Formal charge: 0
Others

7fsu

Type: non-polymer / PDB classification: HETAIN / Three letter code: YDU / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7FSU
History
Create componentJan 26, 2023
Initial releaseFeb 15, 2023
External linksUniChem / ChemSpider / PubChem / ZINC / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 12.01O=C(Nc1nc(C)no1)CC1CCCC1
CACTVS 3.385Cc1noc(NC(=O)CC2CCCC2)n1
OpenEye OEToolkits 2.0.7Cc1nc(on1)NC(=O)CC2CCCC2

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SMILES CANONICAL

CACTVS 3.385Cc1noc(NC(=O)CC2CCCC2)n1
OpenEye OEToolkits 2.0.7Cc1nc(on1)NC(=O)CC2CCCC2

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InChI

InChI 1.06InChI=1S/C10H15N3O2/c1-7-11-10(15-13-7)12-9(14)6-8-4-2-3-5-8/h8H,2-6H2,1H3,(H,11,12,13,14)

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InChIKey

InChI 1.06BXPGKHXJBBUYFC-UHFFFAOYSA-N

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SYSTEMATIC NAME

ACDLabs 12.012-cyclopentyl-N-(3-methyl-1,2,4-oxadiazol-5-yl)acetamide
OpenEye OEToolkits 2.0.72-cyclopentyl-~{N}-(3-methyl-1,2,4-oxadiazol-5-yl)ethanamide

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PDB entries

Showing all 2 items

PDB-7fsu:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z729726784

PDB-8v7u:
PanDDA analysis -- Crystal Structure of Zika virus NS3 Helicase in complex with Z729726784

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