9-[(2S)-butan-2-yl]-N-[2-(1H-indol-3-yl)ethyl]-2-(5-methylpyridin-3-yl)purin-6-amine

Systemtic Name: 9-[(2S)-butan-2-yl]-N-[2-(1H-indol-3-yl)ethyl]-2-(5-methylpyridin-3-yl)purin-6-amine Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-9-[(1S)-1-methylpropyl]-2-(5-methyl-3-pyridyl)purin-6-amine CAS Name: 9-[(2S)-butan-2-yl]-N-[2-(1H-indol-3-yl)ethyl]-2-(5-methyl-3-pyridinyl)-6-purinamine IUPAC Name: 9-[(2S)-butan-2-yl]-N-[2-(1H-indol-3-yl)ethyl]-2-(5-methylpyridin-3-yl)purin-6-amine Traditional Name: 2-(1H-indol-3-yl)ethyl-[9-[(1S)-1-methylpropyl]-2-(5-methyl-3-pyridyl)purin-6-yl]amine Formula: C25H27N7 MolecularWeight: 425.52878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=NC2=C1N=C(N=C2NCCC3=CNC4=CC=CC=C43)C5=CC(=CN=C5)C

Isomeric SMILES

CC[C@H](C)N1C=NC2=C1N=C(N=C2NCCC3=CNC4=CC=CC=C43)C5=CC(=CN=C5)C

InChI

InChI=1S/C25H27N7/c1-4-17(3)32-15-29-22-24(27-10-9-18-14-28-21-8-6-5-7-20(18)21)30-23(31-25(22)32)19-11-16(2)12-26-13-19/h5-8,11-15,17,28H,4,9-10H2,1-3H3,(H,27,30,31)/t17-/m0/s1