2-chloranyl-N-(diphenylmethyl)-9-(oxan-2-yl)purin-6-amine

Systemtic Name: 2-chloranyl-N-(diphenylmethyl)-9-(oxan-2-yl)purin-6-amine Openeye Name: N-benzhydryl-2-chloro-9-tetrahydropyran-2-yl-purin-6-amine CAS Name: 2-chloro-N-(diphenylmethyl)-9-(2-oxanyl)-6-purinamine IUPAC Name: N-benzhydryl-2-chloro-9-(oxan-2-yl)purin-6-amine Traditional Name: benzhydryl-(2-chloro-9-tetrahydropyran-2-yl-purin-6-yl)amine Formula: C23H22ClN5O MolecularWeight: 419.90668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)N2C=NC3=C2N=C(N=C3NC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

C1CCOC(C1)N2C=NC3=C2N=C(N=C3NC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C23H22ClN5O/c24-23-27-21(20-22(28-23)29(15-25-20)18-13-7-8-14-30-18)26-19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,15,18-19H,7-8,13-14H2,(H,26,27,28)