N2-[(2-aminophenyl)methyl]-N6-(3-chlorophenyl)-9-ethyl-purine-2,6-diamine

Systemtic Name: N2-[(2-aminophenyl)methyl]-N6-(3-chlorophenyl)-9-ethyl-purine-2,6-diamine Openeye Name: N2-[(2-aminophenyl)methyl]-N6-(3-chlorophenyl)-9-ethyl-purine-2,6-diamine CAS Name: N2-[(2-aminophenyl)methyl]-N6-(3-chlorophenyl)-9-ethylpurine-2,6-diamine IUPAC Name: 2-N-[(2-aminophenyl)methyl]-6-N-(3-chlorophenyl)-9-ethylpurine-2,6-diamine Traditional Name: (2-aminobenzyl)-[6-(3-chloroanilino)-9-ethyl-purin-2-yl]amine Formula: C20H20ClN7 MolecularWeight: 393.8727

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCC4=CC=CC=C4N

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCC4=CC=CC=C4N

InChI

InChI=1S/C20H20ClN7/c1-2-28-12-24-17-18(25-15-8-5-7-14(21)10-15)26-20(27-19(17)28)23-11-13-6-3-4-9-16(13)22/h3-10,12H,2,11,22H2,1H3,(H2,23,25,26,27)