UVS
5-(methoxymethyl)-1,3,4-thiadiazol-2-amine
Created: | 2020-06-02 |
Last modified: | 2020-06-17 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 16 |
Chiral Atom Count | 0 |
Bond Count | 16 |
Aromatic Bond Count | 5 |
Chemical Component Summary | |
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Name | 5-(methoxymethyl)-1,3,4-thiadiazol-2-amine |
Systematic Name (OpenEye OEToolkits) | 5-(methoxymethyl)-1,3,4-thiadiazol-2-amine |
Formula | C4 H7 N3 O S |
Molecular Weight | 145.183 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | n1nc(COC)sc1N |
SMILES | CACTVS | 3.385 | COCc1sc(N)nn1 |
SMILES | OpenEye OEToolkits | 2.0.7 | COCc1nnc(s1)N |
Canonical SMILES | CACTVS | 3.385 | COCc1sc(N)nn1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | COCc1nnc(s1)N |
InChI | InChI | 1.03 | InChI=1S/C4H7N3OS/c1-8-2-3-6-7-4(5)9-3/h2H2,1H3,(H2,5,7) |
InChIKey | InChI | 1.03 | ZLDOCTTXAVVDHG-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 660844 |
ChEMBL | CHEMBL1430496 |