Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C26H29N5O2/c1-26(14-32-15-26)16-33-20-6-7-22-21(13-20)28-17-31(22)24-8-5-18-3-2-4-23(25(18)29-24)30-11-9-19(27)10-12-30/h2-8,13,17,19H,9-12,14-16,27H2,1H3 |
InChIKey | InChI | 1.03 | DYNHJHQFHQTFTP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC1(COC1)COc2ccc3n(cnc3c2)c4ccc5cccc(N6CCC(N)CC6)c5n4 |
SMILES | CACTVS | 3.385 | CC1(COC1)COc2ccc3n(cnc3c2)c4ccc5cccc(N6CCC(N)CC6)c5n4 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | CC1(COC1)COc2ccc3c(c2)ncn3c4ccc5cccc(c5n4)N6CCC(CC6)N |
SMILES | OpenEye OEToolkits | 2.0.5 | CC1(COC1)COc2ccc3c(c2)ncn3c4ccc5cccc(c5n4)N6CCC(CC6)N |