3-[5-[(4-oxidanylcyclohexyl)amino]-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl]adamantan-1-ol

Systemtic Name: 3-[5-[(4-oxidanylcyclohexyl)amino]-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl]adamantan-1-ol Openeye Name: 3-[5-[(4-hydroxycyclohexyl)amino]triazolo[4,5-d]pyrimidin-3-yl]adamantan-1-ol CAS Name: 3-[5-[(4-hydroxycyclohexyl)amino]-3-triazolo[4,5-d]pyrimidinyl]-1-adamantanol IUPAC Name: 3-[5-[(4-hydroxycyclohexyl)amino]triazolo[4,5-d]pyrimidin-3-yl]adamantan-1-ol Traditional Name: 3-[5-[(4-hydroxycyclohexyl)amino]triazolo[4,5-d]pyrimidin-3-yl]adamantan-1-ol Formula: C20H28N6O2 MolecularWeight: 384.47532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC=C3C(=N2)N(N=N3)C45CC6CC(C4)CC(C6)(C5)O)O

Isomeric SMILES

C1CC(CCC1NC2=NC=C3C(=N2)N(N=N3)C45CC6CC(C4)CC(C6)(C5)O)O

InChI

InChI=1S/C20H28N6O2/c27-15-3-1-14(2-4-15)22-18-21-10-16-17(23-18)26(25-24-16)19-6-12-5-13(7-19)9-20(28,8-12)11-19/h10,12-15,27-28H,1-9,11H2,(H,21,22,23)