2-(ethylamino)-6-(1-methylindol-3-yl)-8-[[(2R)-oxolan-2-yl]methyl]pteridin-7-one

Systemtic Name: 2-(ethylamino)-6-(1-methylindol-3-yl)-8-[[(2R)-oxolan-2-yl]methyl]pteridin-7-one Openeye Name: 2-(ethylamino)-6-(1-methylindol-3-yl)-8-[[(2R)-tetrahydrofuran-2-yl]methyl]pteridin-7-one CAS Name: 2-(ethylamino)-6-(1-methyl-3-indolyl)-8-[[(2R)-2-oxolanyl]methyl]-7-pteridinone IUPAC Name: 2-(ethylamino)-6-(1-methylindol-3-yl)-8-[[(2R)-oxolan-2-yl]methyl]pteridin-7-one Traditional Name: 2-(ethylamino)-6-(1-methylindol-3-yl)-8-[[(2R)-tetrahydrofuran-2-yl]methyl]pteridin-7-one Formula: C22H24N6O2 MolecularWeight: 404.46496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CN(C4=CC=CC=C43)C)CC5CCCO5

Isomeric SMILES

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CN(C4=CC=CC=C43)C)C[C@H]5CCCO5

InChI

InChI=1S/C22H24N6O2/c1-3-23-22-24-11-17-20(26-22)28(12-14-7-6-10-30-14)21(29)19(25-17)16-13-27(2)18-9-5-4-8-15(16)18/h4-5,8-9,11,13-14H,3,6-7,10,12H2,1-2H3,(H,23,24,26)/t14-/m1/s1