2-chloranyl-9-[(4-methoxyphenyl)methyl]-N-(phenylmethyl)purin-6-amine

Systemtic Name: 2-chloranyl-9-[(4-methoxyphenyl)methyl]-N-(phenylmethyl)purin-6-amine Openeye Name: N-benzyl-2-chloro-9-[(4-methoxyphenyl)methyl]purin-6-amine CAS Name: 2-chloro-9-[(4-methoxyphenyl)methyl]-N-(phenylmethyl)-6-purinamine IUPAC Name: N-benzyl-2-chloro-9-[(4-methoxyphenyl)methyl]purin-6-amine Traditional Name: benzyl-(2-chloro-9-p-anisyl-purin-6-yl)amine Formula: C20H18ClN5O MolecularWeight: 379.84282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3NCC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3NCC4=CC=CC=C4)Cl

InChI

InChI=1S/C20H18ClN5O/c1-27-16-9-7-15(8-10-16)12-26-13-23-17-18(24-20(21)25-19(17)26)22-11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H,22,24,25)