S0K
N-[2-(morpholin-4-yl)phenyl]thiophene-3-carboxamide
Created: | 2013-11-07 |
Last modified: | 2014-04-16 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 36 |
Chiral Atom Count | 0 |
Bond Count | 38 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | N-[2-(morpholin-4-yl)phenyl]thiophene-3-carboxamide |
Systematic Name (OpenEye OEToolkits) | N-(2-morpholin-4-ylphenyl)thiophene-3-carboxamide |
Formula | C15 H16 N2 O2 S |
Molecular Weight | 288.365 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(Nc1ccccc1N2CCOCC2)c3ccsc3 |
SMILES | CACTVS | 3.385 | O=C(Nc1ccccc1N2CCOCC2)c3cscc3 |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(c(c1)NC(=O)c2ccsc2)N3CCOCC3 |
Canonical SMILES | CACTVS | 3.385 | O=C(Nc1ccccc1N2CCOCC2)c3cscc3 |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(c(c1)NC(=O)c2ccsc2)N3CCOCC3 |
InChI | InChI | 1.03 | InChI=1S/C15H16N2O2S/c18-15(12-5-10-20-11-12)16-13-3-1-2-4-14(13)17-6-8-19-9-7-17/h1-5,10-11H,6-9H2,(H,16,18) |
InChIKey | InChI | 1.03 | SULRJGWRXWPTDW-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 2813415 |
ChEMBL | CHEMBL3233609 |