N2-phenethyl-N6-phenyl-9-propan-2-yl-purine-2,6-diamine

Systemtic Name: N2-phenethyl-N6-phenyl-9-propan-2-yl-purine-2,6-diamine Openeye Name: 9-isopropyl-N2-phenethyl-N6-phenyl-purine-2,6-diamine CAS Name: N2-phenethyl-N6-phenyl-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 2-N-phenethyl-6-N-phenyl-9-propan-2-ylpurine-2,6-diamine Traditional Name: (6-anilino-9-isopropyl-purin-2-yl)-phenethyl-amine Formula: C22H24N6 MolecularWeight: 372.46616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC=CC=C3)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC=CC=C3)NCCC4=CC=CC=C4

InChI

InChI=1S/C22H24N6/c1-16(2)28-15-24-19-20(25-18-11-7-4-8-12-18)26-22(27-21(19)28)23-14-13-17-9-5-3-6-10-17/h3-12,15-16H,13-14H2,1-2H3,(H2,23,25,26,27)