L5L
(4R)-4-(4-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
Created: | 2022-02-28 |
Last modified: | 2022-10-05 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 32 |
Chiral Atom Count | 1 |
Bond Count | 34 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | (4R)-4-(4-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine |
Systematic Name (OpenEye OEToolkits) | (4~{R})-4-(4-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine |
Formula | C14 H15 N O S |
Molecular Weight | 245.34 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | COc1ccc(cc1)C1NCCc2sccc21 |
SMILES | CACTVS | 3.385 | COc1ccc(cc1)[CH]2NCCc3sccc23 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)C2c3ccsc3CCN2 |
Canonical SMILES | CACTVS | 3.385 | COc1ccc(cc1)[C@H]2NCCc3sccc23 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)[C@@H]2c3ccsc3CCN2 |
InChI | InChI | 1.03 | InChI=1S/C14H15NOS/c1-16-11-4-2-10(3-5-11)14-12-7-9-17-13(12)6-8-15-14/h2-5,7,9,14-15H,6,8H2,1H3/t14-/m1/s1 |
InChIKey | InChI | 1.03 | YZMKEDMYYJQGRD-CQSZACIVSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 6925902 |