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- ChemComp-EHT: 3,5-dimethyl-4-(1-methyl-5-pyridin-4-yl-imidazol-4-yl)-1,2-oxazole -

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Basic information

EntryDatabase: PDB chemical components / ID: EHT
NameName: 3,5-dimethyl-4-(1-methyl-5-pyridin-4-yl-imidazol-4-yl)-1,2-oxazole

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Chemical information

Composition
Formula: C14H14N4O / Number of atoms: 33 / Formula weight: 254.287 / Formal charge: 0
Others

6g2c

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: EHT / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6G2C
History
Create componentMar 23, 2018
Initial releaseJun 26, 2019
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

CACTVS 3.385Cn1cnc(c1c2ccncc2)c3c(C)onc3C
OpenEye OEToolkits 2.0.6Cc1c(c(on1)C)c2c(n(cn2)C)c3ccncc3

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SMILES CANONICAL

CACTVS 3.385Cn1cnc(c1c2ccncc2)c3c(C)onc3C
OpenEye OEToolkits 2.0.6Cc1c(c(on1)C)c2c(n(cn2)C)c3ccncc3

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InChI

InChI 1.03InChI=1S/C14H14N4O/c1-9-12(10(2)19-17-9)13-14(18(3)8-16-13)11-4-6-15-7-5-11/h4-8H,1-3H3

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InChIKey

InChI 1.03XPQAEPLMWBAUIW-UHFFFAOYSA-N

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PDB entries

Showing all 1 items

PDB-6g2c:
X-ray structure of NSD3-PWWP1 in complex with compound 9

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