| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(c2cc(cc1c2nc(n1)NC(=O)NCC)c3cccnc3)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CCNC(=O)Nc1[nH]c2cc(cc(C(C)=O)c2n1)c3cccnc3 |
| SMILES | CACTVS | 3.341 | CCNC(=O)Nc1[nH]c2cc(cc(C(C)=O)c2n1)c3cccnc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCNC(=O)Nc1[nH]c2cc(cc(c2n1)C(=O)C)c3cccnc3 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCNC(=O)Nc1[nH]c2cc(cc(c2n1)C(=O)C)c3cccnc3 |
| InChI | InChI | 1.03 | InChI=1S/C17H17N5O2/c1-3-19-17(24)22-16-20-14-8-12(11-5-4-6-18-9-11)7-13(10(2)23)15(14)21-16/h4-9H,3H2,1-2H3,(H3,19,20,21,22,24) |
| InChIKey | InChI | 1.03 | KDHATIBQZJAMKQ-UHFFFAOYSA-N |
