GHK
4-[3-(phenylsulfonylamino)prop-1-ynyl]benzenesulfonamide
Created: | 2018-09-17 |
Last modified: | 2018-12-26 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 37 |
Chiral Atom Count | 0 |
Bond Count | 38 |
Aromatic Bond Count | 12 |
Chemical Component Summary | |
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Name | 4-[3-(phenylsulfonylamino)prop-1-ynyl]benzenesulfonamide |
Systematic Name (OpenEye OEToolkits) | 4-[3-(phenylsulfonylamino)prop-1-ynyl]benzenesulfonamide |
Formula | C15 H14 N2 O4 S2 |
Molecular Weight | 350.413 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)C#CCN[S](=O)(=O)c2ccccc2 |
SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)S(=O)(=O)NCC#Cc2ccc(cc2)S(=O)(=O)N |
Canonical SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)C#CCN[S](=O)(=O)c2ccccc2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)S(=O)(=O)NCC#Cc2ccc(cc2)S(=O)(=O)N |
InChI | InChI | 1.03 | InChI=1S/C15H14N2O4S2/c16-22(18,19)14-10-8-13(9-11-14)5-4-12-17-23(20,21)15-6-2-1-3-7-15/h1-3,6-11,17H,12H2,(H2,16,18,19) |
InChIKey | InChI | 1.03 | CJZQAMWVHGWYBU-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 135397737 |