N4F
1-(6,7-dihydro-4~{H}-[1,3]thiazolo[5,4-c]pyridin-5-yl)propan-1-one
Created: | 2022-08-11 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 25 |
Chiral Atom Count | 0 |
Bond Count | 26 |
Aromatic Bond Count | 5 |
Chemical Component Summary | |
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Name | 1-(6,7-dihydro-4~{H}-[1,3]thiazolo[5,4-c]pyridin-5-yl)propan-1-one |
Systematic Name (OpenEye OEToolkits) | 1-(6,7-dihydro-4~{H}-[1,3]thiazolo[5,4-c]pyridin-5-yl)propan-1-one |
Formula | C9 H12 N2 O S |
Molecular Weight | 196.269 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CCC(=O)N1CCc2ncsc2C1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCC(=O)N1CCc2c(scn2)C1 |
Canonical SMILES | CACTVS | 3.385 | CCC(=O)N1CCc2ncsc2C1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CCC(=O)N1CCc2c(scn2)C1 |
InChI | InChI | 1.06 | InChI=1S/C9H12N2OS/c1-2-9(12)11-4-3-7-8(5-11)13-6-10-7/h6H,2-5H2,1H3 |
InChIKey | InChI | 1.06 | AIGPRWNLVUWLJG-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 131178689 |