N-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-3-(1-cyclopropylpropyl)purin-6-amine

Systemtic Name: N-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-3-(1-cyclopropylpropyl)purin-6-amine Openeye Name: N-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-3-(1-cyclopropylpropyl)purin-6-amine CAS Name: N-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-3-(1-cyclopropylpropyl)-6-purinamine IUPAC Name: N-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-3-(1-cyclopropylpropyl)purin-6-amine Traditional Name: [3-(cyclopentoxy)-4-methoxy-benzyl]-[3-(1-cyclopropylpropyl)purin-6-yl]amine Formula: C24H31N5O2 MolecularWeight: 421.53524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CC1)N2C=NC(=C3C2=NC=N3)NCC4=CC(=C(C=C4)OC)OC5CCCC5

Isomeric SMILES

CCC(C1CC1)N2C=NC(=C3C2=NC=N3)NCC4=CC(=C(C=C4)OC)OC5CCCC5

InChI

InChI=1S/C24H31N5O2/c1-3-19(17-9-10-17)29-15-28-23(22-24(29)27-14-26-22)25-13-16-8-11-20(30-2)21(12-16)31-18-6-4-5-7-18/h8,11-12,14-15,17-19,25H,3-7,9-10,13H2,1-2H3