9-methyl-2-phenethyl-N,N-bis(phenylmethyl)-8-(1,2,3-triazol-1-yl)purin-6-amine

Systemtic Name: 9-methyl-2-phenethyl-N,N-bis(phenylmethyl)-8-(1,2,3-triazol-1-yl)purin-6-amine Openeye Name: N,N-dibenzyl-9-methyl-2-phenethyl-8-(triazol-1-yl)purin-6-amine CAS Name: 9-methyl-2-phenethyl-N,N-bis(phenylmethyl)-8-(1-triazolyl)-6-purinamine IUPAC Name: N,N-dibenzyl-9-methyl-2-phenethyl-8-(triazol-1-yl)purin-6-amine Traditional Name: dibenzyl-[9-methyl-2-phenethyl-8-(triazol-1-yl)purin-6-yl]amine Formula: C30H28N8 MolecularWeight: 500.59692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)CCC3=CC=CC=C3)N(CC4=CC=CC=C4)CC5=CC=CC=C5)N=C1N6C=CN=N6

Isomeric SMILES

CN1C2=C(C(=NC(=N2)CCC3=CC=CC=C3)N(CC4=CC=CC=C4)CC5=CC=CC=C5)N=C1N6C=CN=N6

InChI

InChI=1S/C30H28N8/c1-36-28-27(34-30(36)38-20-19-31-35-38)29(33-26(32-28)18-17-23-11-5-2-6-12-23)37(21-24-13-7-3-8-14-24)22-25-15-9-4-10-16-25/h2-16,19-20H,17-18,21-22H2,1H3