Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C(NCCCCCn2ccc1cc(c(cc12)Cl)Cl)(CS)=O |
InChI | InChI | 1.03 | InChI=1S/C15H18Cl2N2OS/c16-12-8-11-4-7-19(14(11)9-13(12)17)6-3-1-2-5-18-15(20)10-21/h4,7-9,21H,1-3,5-6,10H2,(H,18,20) |
InChIKey | InChI | 1.03 | MHKHGVSRGWQPII-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | SCC(=O)NCCCCCn1ccc2cc(Cl)c(Cl)cc12 |
SMILES | CACTVS | 3.385 | SCC(=O)NCCCCCn1ccc2cc(Cl)c(Cl)cc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cn(c2c1cc(c(c2)Cl)Cl)CCCCCNC(=O)CS |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cn(c2c1cc(c(c2)Cl)Cl)CCCCCNC(=O)CS |