Y3Y
Summary
| Name: | (2R)-N-(2-methoxyethyl)-2-methyl-4-thiophen-2-ylcarbonyl-piperazine-1-carboxamide |
| Formula: | C14 H21 N3 O3 S |
| Formal charge: | 0 |
| Formula weight: | 311.4 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R})-~{N}-(2-methoxyethyl)-2-methyl-4-thiophen-2-ylcarbonyl-piperazine-1-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H21N3O3S/c1-11-10-16(13(18)12-4-3-9-21-12)6-7-17(11)14(19)15-5-8-20-2/h3-4,9,11H,5-8,10H2,1-2H3,(H,15,19)/t11-/m1/s1 |
| InChIKey | InChI | 1.06 | PMIQPYIXNLYXTF-LLVKDONJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COCCNC(=O)N1CCN(C[C@H]1C)C(=O)c2sccc2 |
| SMILES | CACTVS | 3.385 | COCCNC(=O)N1CCN(C[CH]1C)C(=O)c2sccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@@H]1CN(CCN1C(=O)NCCOC)C(=O)c2cccs2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1CN(CCN1C(=O)NCCOC)C(=O)c2cccs2 |
