N-(2-methoxyethyl)-2-methyl-8-phenyl-9-(2-pyrrolidin-1-ylethyl)purin-6-amine

Systemtic Name: N-(2-methoxyethyl)-2-methyl-8-phenyl-9-(2-pyrrolidin-1-ylethyl)purin-6-amine Openeye Name: N-(2-methoxyethyl)-2-methyl-8-phenyl-9-(2-pyrrolidin-1-ylethyl)purin-6-amine CAS Name: N-(2-methoxyethyl)-2-methyl-8-phenyl-9-[2-(1-pyrrolidinyl)ethyl]-6-purinamine IUPAC Name: N-(2-methoxyethyl)-2-methyl-8-phenyl-9-(2-pyrrolidin-1-ylethyl)purin-6-amine Traditional Name: 2-methoxyethyl-[2-methyl-8-phenyl-9-(2-pyrrolidinoethyl)purin-6-yl]amine Formula: C21H28N6O MolecularWeight: 380.48662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NCCOC)N=C(N2CCN3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=N1)NCCOC)N=C(N2CCN3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H28N6O/c1-16-23-19(22-10-15-28-2)18-21(24-16)27(14-13-26-11-6-7-12-26)20(25-18)17-8-4-3-5-9-17/h3-5,8-9H,6-7,10-15H2,1-2H3,(H,22,23,24)