9EZ
2-methyl-5-phenyl-pyrazol-3-amine
Created: | 2017-05-15 |
Last modified: | 2017-06-14 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 24 |
Chiral Atom Count | 0 |
Bond Count | 25 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | 2-methyl-5-phenyl-pyrazol-3-amine |
Systematic Name (OpenEye OEToolkits) | 2-methyl-5-phenyl-pyrazol-3-amine |
Formula | C10 H11 N3 |
Molecular Weight | 173.214 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | Cn1nc(cc1N)c2ccccc2 |
SMILES | OpenEye OEToolkits | 2.0.6 | Cn1c(cc(n1)c2ccccc2)N |
Canonical SMILES | CACTVS | 3.385 | Cn1nc(cc1N)c2ccccc2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | Cn1c(cc(n1)c2ccccc2)N |
InChI | InChI | 1.03 | InChI=1S/C10H11N3/c1-13-10(11)7-9(12-13)8-5-3-2-4-6-8/h2-7H,11H2,1H3 |
InChIKey | InChI | 1.03 | KCYRMURRLLYLPU-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 517779 |
ChEMBL | CHEMBL4084029 |