N,9-bis(4-ethylphenyl)-6-methyl-purin-2-amine

Systemtic Name: N,9-bis(4-ethylphenyl)-6-methyl-purin-2-amine Openeye Name: N,9-bis(4-ethylphenyl)-6-methyl-purin-2-amine CAS Name: N,9-bis(4-ethylphenyl)-6-methyl-2-purinamine IUPAC Name: N,9-bis(4-ethylphenyl)-6-methylpurin-2-amine Traditional Name: (4-ethylphenyl)-[9-(4-ethylphenyl)-6-methyl-purin-2-yl]amine Formula: C22H23N5 MolecularWeight: 357.45152

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC(=C3C(=N2)N(C=N3)C4=CC=C(C=C4)CC)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC(=C3C(=N2)N(C=N3)C4=CC=C(C=C4)CC)C

InChI

InChI=1S/C22H23N5/c1-4-16-6-10-18(11-7-16)25-22-24-15(3)20-21(26-22)27(14-23-20)19-12-8-17(5-2)9-13-19/h6-14H,4-5H2,1-3H3,(H,24,25,26)