ERZ
~{N}-(1,5-dimethylpyrazol-4-yl)-5-methyl-pyrimidin-2-amine
Created: | 2018-04-11 |
Last modified: | 2018-05-30 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 28 |
Chiral Atom Count | 0 |
Bond Count | 29 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | ~{N}-(1,5-dimethylpyrazol-4-yl)-5-methyl-pyrimidin-2-amine |
Systematic Name (OpenEye OEToolkits) | ~{N}-(1,5-dimethylpyrazol-4-yl)-5-methyl-pyrimidin-2-amine |
Formula | C10 H13 N5 |
Molecular Weight | 203.244 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | Cn1ncc(Nc2ncc(C)cn2)c1C |
SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cnc(nc1)Nc2cnn(c2C)C |
Canonical SMILES | CACTVS | 3.385 | Cn1ncc(Nc2ncc(C)cn2)c1C |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cnc(nc1)Nc2cnn(c2C)C |
InChI | InChI | 1.03 | InChI=1S/C10H13N5/c1-7-4-11-10(12-5-7)14-9-6-13-15(3)8(9)2/h4-6H,1-3H3,(H,11,12,14) |
InChIKey | InChI | 1.03 | XMVHLWOPQDOPRZ-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 134129122 |
ChEMBL | CHEMBL4210146 |