VVT
6-chloro-3-phenyl-4-(pyridin-4-yl)pyridazine
Created: | 2015-05-15 |
Last modified: | 2016-07-07 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 29 |
Chiral Atom Count | 0 |
Bond Count | 31 |
Aromatic Bond Count | 18 |
Chemical Component Summary | |
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Name | 6-chloro-3-phenyl-4-(pyridin-4-yl)pyridazine |
Systematic Name (OpenEye OEToolkits) | 6-chloranyl-3-phenyl-4-pyridin-4-yl-pyridazine |
Formula | C15 H10 Cl N3 |
Molecular Weight | 267.713 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Clc2cc(c1ccncc1)c(nn2)c3ccccc3 |
SMILES | CACTVS | 3.385 | Clc1cc(c2ccncc2)c(nn1)c3ccccc3 |
SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)c2c(cc(nn2)Cl)c3ccncc3 |
Canonical SMILES | CACTVS | 3.385 | Clc1cc(c2ccncc2)c(nn1)c3ccccc3 |
Canonical SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)c2c(cc(nn2)Cl)c3ccncc3 |
InChI | InChI | 1.03 | InChI=1S/C15H10ClN3/c16-14-10-13(11-6-8-17-9-7-11)15(19-18-14)12-4-2-1-3-5-12/h1-10H |
InChIKey | InChI | 1.03 | FHQYQYMBRPYWIY-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 87264666 |