| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Nc1cc2CCCCc2nc1SC)N1CCCC(C1)C(N)=O |
| InChI | InChI | 1.06 | InChI=1S/C17H24N4O2S/c1-24-16-14(9-11-5-2-3-7-13(11)19-16)20-17(23)21-8-4-6-12(10-21)15(18)22/h9,12H,2-8,10H2,1H3,(H2,18,22)(H,20,23)/t12-/m0/s1 |
| InChIKey | InChI | 1.06 | CTFZKMLNMWYZII-LBPRGKRZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CSc1nc2CCCCc2cc1NC(=O)N3CCC[C@@H](C3)C(N)=O |
| SMILES | CACTVS | 3.385 | CSc1nc2CCCCc2cc1NC(=O)N3CCC[CH](C3)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CSc1c(cc2c(n1)CCCC2)NC(=O)N3CCC[C@@H](C3)C(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CSc1c(cc2c(n1)CCCC2)NC(=O)N3CCCC(C3)C(=O)N |
