3-[(4-chlorophenyl)methyl]-N2,N6-diethyl-8-propan-2-yl-purine-2,6-diamine

Systemtic Name: 3-[(4-chlorophenyl)methyl]-N2,N6-diethyl-8-propan-2-yl-purine-2,6-diamine Openeye Name: 3-[(4-chlorophenyl)methyl]-N2,N6-diethyl-8-isopropyl-purine-2,6-diamine CAS Name: 3-[(4-chlorophenyl)methyl]-N2,N6-diethyl-8-propan-2-ylpurine-2,6-diamine IUPAC Name: 3-[(4-chlorophenyl)methyl]-2-N,6-N-diethyl-8-propan-2-ylpurine-2,6-diamine Traditional Name: [3-(4-chlorobenzyl)-2-(ethylamino)-8-isopropyl-purin-6-yl]-ethyl-amine Formula: C19H25ClN6 MolecularWeight: 372.895

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25ClN6/c1-5-21-17-15-18(24-16(23-15)12(3)4)26(19(25-17)22-6-2)11-13-7-9-14(20)10-8-13/h7-10,12,21H,5-6,11H2,1-4H3,(H,22,25)