[(2R)-2-[9-cyclopentyl-6-[(phenylmethyl)amino]purin-2-yl]pyrrolidin-1-yl]methanol

Systemtic Name: [(2R)-2-[9-cyclopentyl-6-[(phenylmethyl)amino]purin-2-yl]pyrrolidin-1-yl]methanol Openeye Name: [(2R)-2-[6-(benzylamino)-9-cyclopentyl-purin-2-yl]pyrrolidin-1-yl]methanol CAS Name: [(2R)-2-[9-cyclopentyl-6-[(phenylmethyl)amino]-2-purinyl]-1-pyrrolidinyl]methanol IUPAC Name: [(2R)-2-[6-(benzylamino)-9-cyclopentylpurin-2-yl]pyrrolidin-1-yl]methanol Traditional Name: [(2R)-2-[6-(benzylamino)-9-cyclopentyl-purin-2-yl]pyrrolidino]methanol Formula: C22H28N6O MolecularWeight: 392.49732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCC4=CC=CC=C4)C5CCCN5CO

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCC4=CC=CC=C4)[C@H]5CCCN5CO

InChI

InChI=1S/C22H28N6O/c29-15-27-12-6-11-18(27)20-25-21(23-13-16-7-2-1-3-8-16)19-22(26-20)28(14-24-19)17-9-4-5-10-17/h1-3,7-8,14,17-18,29H,4-6,9-13,15H2,(H,23,25,26)/t18-/m1/s1