GUY
~{N}-(1-propyl-1,2,3,4-tetrazol-5-yl)furan-2-carboxamide
Created: | 2018-06-01 |
Last modified: | 2018-10-10 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 27 |
Chiral Atom Count | 0 |
Bond Count | 28 |
Aromatic Bond Count | 10 |
Chemical Component Summary | |
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Name | ~{N}-(1-propyl-1,2,3,4-tetrazol-5-yl)furan-2-carboxamide |
Systematic Name (OpenEye OEToolkits) | ~{N}-(1-propyl-1,2,3,4-tetrazol-5-yl)furan-2-carboxamide |
Formula | C9 H11 N5 O2 |
Molecular Weight | 221.216 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CCCn1nnnc1NC(=O)c2occc2 |
SMILES | OpenEye OEToolkits | 2.0.6 | CCCn1c(nnn1)NC(=O)c2ccco2 |
Canonical SMILES | CACTVS | 3.385 | CCCn1nnnc1NC(=O)c2occc2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | CCCn1c(nnn1)NC(=O)c2ccco2 |
InChI | InChI | 1.03 | InChI=1S/C9H11N5O2/c1-2-5-14-9(11-12-13-14)10-8(15)7-4-3-6-16-7/h3-4,6H,2,5H2,1H3,(H,10,11,13,15) |
InChIKey | InChI | 1.03 | XGSKVFLLSUZGMA-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 960197 |