Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | NC(=O)c1c2cc(C)c(C)nc2n(c1N)c1c(C)ccc(O)c1C |
InChI | InChI | 1.03 | InChI=1S/C18H20N4O2/c1-8-5-6-13(23)10(3)15(8)22-16(19)14(17(20)24)12-7-9(2)11(4)21-18(12)22/h5-7,23H,19H2,1-4H3,(H2,20,24) |
InChIKey | InChI | 1.03 | ARBRHWRTXPWZGN-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc2c(nc1C)n(c(N)c2C(N)=O)c3c(C)ccc(O)c3C |
SMILES | CACTVS | 3.385 | Cc1cc2c(nc1C)n(c(N)c2C(N)=O)c3c(C)ccc(O)c3C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(c(c1n2c(c(c3c2nc(c(c3)C)C)C(=O)N)N)C)O |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(c(c1n2c(c(c3c2nc(c(c3)C)C)C(=O)N)N)C)O |