| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)NCCCN2C3=NC(=O)NC(=O)C3=Nc1cc(c(cc12)C)C |
| InChI | InChI | 1.03 | InChI=1S/C16H17N5O4/c1-8-6-10-11(7-9(8)2)21(5-3-4-17-16(24)25)13-12(18-10)14(22)20-15(23)19-13/h6-7,17H,3-5H2,1-2H3,(H,24,25)(H,20,22,23) |
| InChIKey | InChI | 1.03 | SDVCPFDZIJESAH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc2N=C3C(=O)NC(=O)N=C3N(CCCNC(O)=O)c2cc1C |
| SMILES | CACTVS | 3.385 | Cc1cc2N=C3C(=O)NC(=O)N=C3N(CCCNC(O)=O)c2cc1C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)CCCNC(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)CCCNC(=O)O |
