4-[[4-[(4-phenoxyphenyl)amino]pyrimido[5,4-d]pyrimidin-6-yl]amino]cyclohexan-1-ol

Systemtic Name: 4-[[4-[(4-phenoxyphenyl)amino]pyrimido[5,4-d]pyrimidin-6-yl]amino]cyclohexan-1-ol Openeye Name: 4-[[4-(4-phenoxyanilino)pyrimido[5,4-d]pyrimidin-6-yl]amino]cyclohexanol CAS Name: 4-[[4-(4-phenoxyanilino)-6-pyrimido[5,4-d]pyrimidinyl]amino]-1-cyclohexanol IUPAC Name: 4-[[4-(4-phenoxyanilino)pyrimido[5,4-d]pyrimidin-6-yl]amino]cyclohexan-1-ol Traditional Name: 4-[[4-(4-phenoxyanilino)pyrimido[5,4-d]pyrimidin-6-yl]amino]cyclohexanol Formula: C24H24N6O2 MolecularWeight: 428.48636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5)O

Isomeric SMILES

C1CC(CCC1NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5)O

InChI

InChI=1S/C24H24N6O2/c31-18-10-6-17(7-11-18)29-24-25-14-21-22(30-24)23(27-15-26-21)28-16-8-12-20(13-9-16)32-19-4-2-1-3-5-19/h1-5,8-9,12-15,17-18,31H,6-7,10-11H2,(H,25,29,30)(H,26,27,28)