| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2(cc(CCc1cc(C)cc(N)n1)cc(c2)F)C#CCNC |
| InChI | InChI | 1.03 | InChI=1S/C18H20FN3/c1-13-8-17(22-18(20)9-13)6-5-15-10-14(4-3-7-21-2)11-16(19)12-15/h8-12,21H,5-7H2,1-2H3,(H2,20,22) |
| InChIKey | InChI | 1.03 | YNFSNSWWKPMRND-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNCC#Cc1cc(F)cc(CCc2cc(C)cc(N)n2)c1 |
| SMILES | CACTVS | 3.385 | CNCC#Cc1cc(F)cc(CCc2cc(C)cc(N)n2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cc(nc(c1)N)CCc2cc(cc(c2)F)C#CCNC |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cc(nc(c1)N)CCc2cc(cc(c2)F)C#CCNC |
