Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(c2cccc1c(c3c(nc12)cccc3)N)NCCCCN(C)C |
SMILES_CANONICAL | CACTVS | 3.341 | CN(C)CCCCNC(=O)c1cccc2c(N)c3ccccc3nc12 |
SMILES | CACTVS | 3.341 | CN(C)CCCCNC(=O)c1cccc2c(N)c3ccccc3nc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN(C)CCCCNC(=O)c1cccc2c1nc3ccccc3c2N |
SMILES | OpenEye OEToolkits | 1.5.0 | CN(C)CCCCNC(=O)c1cccc2c1nc3ccccc3c2N |
InChI | InChI | 1.03 | InChI=1S/C20H24N4O/c1-24(2)13-6-5-12-22-20(25)16-10-7-9-15-18(21)14-8-3-4-11-17(14)23-19(15)16/h3-4,7-11H,5-6,12-13H2,1-2H3,(H2,21,23)(H,22,25) |
InChIKey | InChI | 1.03 | AMFZHKPIXJORQY-UHFFFAOYSA-N |