V1H
3-methoxy-1-(4-methylphenyl)sulfonyl-azetidine
Created: | 2021-04-06 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 31 |
Chiral Atom Count | 0 |
Bond Count | 32 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 3-methoxy-1-(4-methylphenyl)sulfonyl-azetidine |
Systematic Name (OpenEye OEToolkits) | 3-methoxy-1-(4-methylphenyl)sulfonyl-azetidine |
Formula | C11 H15 N O3 S |
Molecular Weight | 241.307 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | COC1CN(C1)[S](=O)(=O)c2ccc(C)cc2 |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)S(=O)(=O)N2CC(C2)OC |
Canonical SMILES | CACTVS | 3.385 | COC1CN(C1)[S](=O)(=O)c2ccc(C)cc2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)S(=O)(=O)N2CC(C2)OC |
InChI | InChI | 1.03 | InChI=1S/C11H15NO3S/c1-9-3-5-11(6-4-9)16(13,14)12-7-10(8-12)15-2/h3-6,10H,7-8H2,1-2H3 |
InChIKey | InChI | 1.03 | FVWRQPKSKSFJCP-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 155923754 |