9-butyl-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine

Systemtic Name: 9-butyl-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine Openeye Name: 9-butyl-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine CAS Name: 9-butyl-8-[(3,4,5-trimethoxyphenyl)methyl]-6-purinamine IUPAC Name: 9-butyl-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine Traditional Name: [9-butyl-8-(3,4,5-trimethoxybenzyl)purin-6-yl]amine Formula: C19H25N5O3 MolecularWeight: 371.4335

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1N=CN=C2N)CC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCCCN1C(=NC2=C1N=CN=C2N)CC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C19H25N5O3/c1-5-6-7-24-15(23-16-18(20)21-11-22-19(16)24)10-12-8-13(25-2)17(27-4)14(9-12)26-3/h8-9,11H,5-7,10H2,1-4H3,(H2,20,21,22)