Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(c1cccc(O)c1C)Nc3c2cc(C(=[N@H])N)ccc2ccc3 |
SMILES_CANONICAL | CACTVS | 3.341 | Cc1c(O)cccc1C(=O)Nc2cccc3ccc(cc23)C(N)=N |
SMILES | CACTVS | 3.341 | Cc1c(O)cccc1C(=O)Nc2cccc3ccc(cc23)C(N)=N |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | [H]/N=C(\c1ccc2cccc(c2c1)NC(=O)c3cccc(c3C)O)/N |
SMILES | OpenEye OEToolkits | 1.5.0 | [H]N=C(c1ccc2cccc(c2c1)NC(=O)c3cccc(c3C)O)N |
InChI | InChI | 1.03 | InChI=1S/C19H17N3O2/c1-11-14(5-3-7-17(11)23)19(24)22-16-6-2-4-12-8-9-13(18(20)21)10-15(12)16/h2-10,23H,1H3,(H3,20,21)(H,22,24) |
InChIKey | InChI | 1.03 | NNGZRCYXFBHMRM-UHFFFAOYSA-N |