9-methyl-2-pentyl-N,N-bis(phenylmethyl)purin-6-amine

Systemtic Name: 9-methyl-2-pentyl-N,N-bis(phenylmethyl)purin-6-amine Openeye Name: N,N-dibenzyl-9-methyl-2-pentyl-purin-6-amine CAS Name: 9-methyl-2-pentyl-N,N-bis(phenylmethyl)-6-purinamine IUPAC Name: N,N-dibenzyl-9-methyl-2-pentylpurin-6-amine Traditional Name: (2-amyl-9-methyl-purin-6-yl)-dibenzyl-amine Formula: C25H29N5 MolecularWeight: 399.53126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC2=C(C(=N1)N(CC3=CC=CC=C3)CC4=CC=CC=C4)N=CN2C

Isomeric SMILES

CCCCCC1=NC2=C(C(=N1)N(CC3=CC=CC=C3)CC4=CC=CC=C4)N=CN2C

InChI

InChI=1S/C25H29N5/c1-3-4-7-16-22-27-24-23(26-19-29(24)2)25(28-22)30(17-20-12-8-5-9-13-20)18-21-14-10-6-11-15-21/h5-6,8-15,19H,3-4,7,16-18H2,1-2H3