| PDB CCD ID: | N48 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C19 H17 N3 O4 S |
| InChI: | InChI=1S/C19H17N3O4S/c1-12-8-19(23)22(2)17-10-18(26-3)16(9-15(12)17)21-27(24,25)14-6-4-13(11-20)5-7-14/h4-10,21H,1-3H3 |
| InChIKey: | OHKRNOLZIOHQBM-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.5 | CC1=CC(=O)N(c2c1cc(c(c2)OC)NS(=O)(=O)c3ccc(cc3)C#N)C | | CACTVS 3.385 | COc1cc2N(C)C(=O)C=C(C)c2cc1N[S](=O)(=O)c3ccc(cc3)C#N | | ACDLabs 12.01 | O=C1C=C(C)c2c(N1C)cc(c(c2)NS(=O)(=O)c3ccc(cc3)C#N)OC |
|
| Name: | 4-cyano-N-(7-methoxy-1,4-dimethyl-2-oxo-1,2-dihydroquinolin-6-yl)benzene-1-sulfonamide |
| ChEMBL: | CHEMBL4096095 |
| ZINC: | ZINC000584905781 |
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