3-[(4-chlorophenyl)methyl]-N-ethyl-purin-6-amine

Systemtic Name: 3-[(4-chlorophenyl)methyl]-N-ethyl-purin-6-amine Openeye Name: 3-[(4-chlorophenyl)methyl]-N-ethyl-purin-6-amine CAS Name: 3-[(4-chlorophenyl)methyl]-N-ethyl-6-purinamine IUPAC Name: 3-[(4-chlorophenyl)methyl]-N-ethylpurin-6-amine Traditional Name: [3-(4-chlorobenzyl)purin-6-yl]-ethyl-amine Formula: C14H14ClN5 MolecularWeight: 287.74746

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C2C(=NC=N2)N(C=N1)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCNC1=C2C(=NC=N2)N(C=N1)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H14ClN5/c1-2-16-13-12-14(18-8-17-12)20(9-19-13)7-10-3-5-11(15)6-4-10/h3-6,8-9,16H,2,7H2,1H3