02Z
4-amino-2-(phenylamino)-1,3-thiazole-5-carboxamide
Created: | 2011-05-12 |
Last modified: | 2012-10-26 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 26 |
Chiral Atom Count | 0 |
Bond Count | 27 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | 4-amino-2-(phenylamino)-1,3-thiazole-5-carboxamide |
Systematic Name (OpenEye OEToolkits) | 4-azanyl-2-phenylazanyl-1,3-thiazole-5-carboxamide |
Formula | C10 H10 N4 O S |
Molecular Weight | 234.278 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(c1sc(nc1N)Nc2ccccc2)N |
SMILES | CACTVS | 3.370 | NC(=O)c1sc(Nc2ccccc2)nc1N |
SMILES | OpenEye OEToolkits | 1.7.2 | c1ccc(cc1)Nc2nc(c(s2)C(=O)N)N |
Canonical SMILES | CACTVS | 3.370 | NC(=O)c1sc(Nc2ccccc2)nc1N |
Canonical SMILES | OpenEye OEToolkits | 1.7.2 | c1ccc(cc1)Nc2nc(c(s2)C(=O)N)N |
InChI | InChI | 1.03 | InChI=1S/C10H10N4OS/c11-8-7(9(12)15)16-10(14-8)13-6-4-2-1-3-5-6/h1-5H,11H2,(H2,12,15)(H,13,14) |
InChIKey | InChI | 1.03 | NLHYHLPSUOFMHW-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 13349420 |
ChEMBL | CHEMBL2377833 |