9-(oxan-2-yl)-6-(phenethylamino)purine-2-carbonitrile

Systemtic Name: 9-(oxan-2-yl)-6-(phenethylamino)purine-2-carbonitrile Openeye Name: 6-(phenethylamino)-9-tetrahydropyran-2-yl-purine-2-carbonitrile CAS Name: 9-(2-oxanyl)-6-(phenethylamino)-2-purinecarbonitrile IUPAC Name: 9-(oxan-2-yl)-6-(phenethylamino)purine-2-carbonitrile Traditional Name: 6-(phenethylamino)-9-tetrahydropyran-2-yl-purine-2-carbonitrile Formula: C19H20N6O MolecularWeight: 348.4017

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)N2C=NC3=C2N=C(N=C3NCCC4=CC=CC=C4)C#N

Isomeric SMILES

C1CCOC(C1)N2C=NC3=C2N=C(N=C3NCCC4=CC=CC=C4)C#N

InChI

InChI=1S/C19H20N6O/c20-12-15-23-18(21-10-9-14-6-2-1-3-7-14)17-19(24-15)25(13-22-17)16-8-4-5-11-26-16/h1-3,6-7,13,16H,4-5,8-11H2,(H,21,23,24)