| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | Clc1c(ccc(c1)NC(=O)NCCSCc2oc(cc2)CN(C)C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CN(C)Cc1oc(CSCCNC(=O)Nc2ccc(C)c(Cl)c2)cc1 |
| SMILES | CACTVS | 3.341 | CN(C)Cc1oc(CSCCNC(=O)Nc2ccc(C)c(Cl)c2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1ccc(cc1Cl)NC(=O)NCCSCc2ccc(o2)CN(C)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1ccc(cc1Cl)NC(=O)NCCSCc2ccc(o2)CN(C)C |
| InChI | InChI | 1.03 | InChI=1S/C18H24ClN3O2S/c1-13-4-5-14(10-17(13)19)21-18(23)20-8-9-25-12-16-7-6-15(24-16)11-22(2)3/h4-7,10H,8-9,11-12H2,1-3H3,(H2,20,21,23) |
| InChIKey | InChI | 1.03 | WEYNBWVKOYCCQT-UHFFFAOYSA-N |
