Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | n3c2ccc1c(ccn1C(COC)COC)c2c(nc3N)N |
SMILES_CANONICAL | CACTVS | 3.341 | COCC(COC)n1ccc2c1ccc3nc(N)nc(N)c23 |
SMILES | CACTVS | 3.341 | COCC(COC)n1ccc2c1ccc3nc(N)nc(N)c23 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | COCC(COC)n1ccc2c1ccc3c2c(nc(n3)N)N |
SMILES | OpenEye OEToolkits | 1.5.0 | COCC(COC)n1ccc2c1ccc3c2c(nc(n3)N)N |
InChI | InChI | 1.03 | InChI=1S/C15H19N5O2/c1-21-7-9(8-22-2)20-6-5-10-12(20)4-3-11-13(10)14(16)19-15(17)18-11/h3-6,9H,7-8H2,1-2H3,(H4,16,17,18,19) |
InChIKey | InChI | 1.03 | MQTGHZCEDQNMOZ-UHFFFAOYSA-N |