Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | n1ncn(C(C)C)c1c3cccc(NC(=O)c2cc(C(=O)NC)ccc2OC)n3 |
InChI | InChI | 1.03 | InChI=1S/C20H22N6O3/c1-12(2)26-11-22-25-18(26)15-6-5-7-17(23-15)24-20(28)14-10-13(19(27)21-3)8-9-16(14)29-4/h5-12H,1-4H3,(H,21,27)(H,23,24,28) |
InChIKey | InChI | 1.03 | WOQOZRHVLYUXPM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)c1ccc(OC)c(c1)C(=O)Nc2cccc(n2)c3nncn3C(C)C |
SMILES | CACTVS | 3.385 | CNC(=O)c1ccc(OC)c(c1)C(=O)Nc2cccc(n2)c3nncn3C(C)C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(C)n1cnnc1c2cccc(n2)NC(=O)c3cc(ccc3OC)C(=O)NC |
SMILES | OpenEye OEToolkits | 2.0.6 | CC(C)n1cnnc1c2cccc(n2)NC(=O)c3cc(ccc3OC)C(=O)NC |