QPZ
Summary
| Name: | 1,4-dimethyl-2-oxidanylidene-~{N}-(phenylmethyl)quinoline-6-sulfonamide |
| Formula: | C18 H18 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 342.412 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1,4-dimethyl-2-oxidanylidene-~{N}-(phenylmethyl)quinoline-6-sulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H18N2O3S/c1-13-10-18(21)20(2)17-9-8-15(11-16(13)17)24(22,23)19-12-14-6-4-3-5-7-14/h3-11,19H,12H2,1-2H3 |
| InChIKey | InChI | 1.03 | KBXRBUMRPUNHEH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1C(=O)C=C(C)c2cc(ccc12)[S](=O)(=O)NCc3ccccc3 |
| SMILES | CACTVS | 3.385 | CN1C(=O)C=C(C)c2cc(ccc12)[S](=O)(=O)NCc3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC1=CC(=O)N(c2c1cc(cc2)S(=O)(=O)NCc3ccccc3)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1=CC(=O)N(c2c1cc(cc2)S(=O)(=O)NCc3ccccc3)C |
