Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C19H23N3O3S/c1-21-11-12-22(14-17(21)13-15-5-3-2-4-6-15)19(23)16-7-9-18(10-8-16)26(20,24)25/h2-10,17H,11-14H2,1H3,(H2,20,24,25)/t17-/m0/s1 |
InChIKey | InChI | 1.03 | NNDPMPAUZZKJMK-KRWDZBQOSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN1CCN(C[C@@H]1Cc2ccccc2)C(=O)c3ccc(cc3)[S](N)(=O)=O |
SMILES | CACTVS | 3.385 | CN1CCN(C[CH]1Cc2ccccc2)C(=O)c3ccc(cc3)[S](N)(=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1CCN(C[C@@H]1Cc2ccccc2)C(=O)c3ccc(cc3)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | CN1CCN(CC1Cc2ccccc2)C(=O)c3ccc(cc3)S(=O)(=O)N |