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

Systemtic Name: 2-chloranyl-N-[(4-methoxyphenyl)methyl]-9-(oxan-2-yl)purin-6-amine Openeye Name: 2-chloro-N-[(4-methoxyphenyl)methyl]-9-tetrahydropyran-2-yl-purin-6-amine CAS Name: 2-chloro-N-[(4-methoxyphenyl)methyl]-9-(2-oxanyl)-6-purinamine IUPAC Name: 2-chloro-N-[(4-methoxyphenyl)methyl]-9-(oxan-2-yl)purin-6-amine Traditional Name: (2-chloro-9-tetrahydropyran-2-yl-purin-6-yl)-p-anisyl-amine Formula: C18H20ClN5O2 MolecularWeight: 373.8367

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC(=NC3=C2N=CN3C4CCCCO4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC(=NC3=C2N=CN3C4CCCCO4)Cl

InChI

InChI=1S/C18H20ClN5O2/c1-25-13-7-5-12(6-8-13)10-20-16-15-17(23-18(19)22-16)24(11-21-15)14-4-2-3-9-26-14/h5-8,11,14H,2-4,9-10H2,1H3,(H,20,22,23)