6-(3,5-dimethoxyphenyl)-8-ethyl-2-(pyridin-4-ylamino)pteridin-7-one

Systemtic Name: 6-(3,5-dimethoxyphenyl)-8-ethyl-2-(pyridin-4-ylamino)pteridin-7-one Openeye Name: 6-(3,5-dimethoxyphenyl)-8-ethyl-2-(4-pyridylamino)pteridin-7-one CAS Name: 6-(3,5-dimethoxyphenyl)-8-ethyl-2-(pyridin-4-ylamino)-7-pteridinone IUPAC Name: 6-(3,5-dimethoxyphenyl)-8-ethyl-2-(pyridin-4-ylamino)pteridin-7-one Traditional Name: 6-(3,5-dimethoxyphenyl)-8-ethyl-2-(4-pyridylamino)pteridin-7-one Formula: C21H20N6O3 MolecularWeight: 404.4219

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=NC=C2N=C(C1=O)C3=CC(=CC(=C3)OC)OC)NC4=CC=NC=C4

Isomeric SMILES

CCN1C2=NC(=NC=C2N=C(C1=O)C3=CC(=CC(=C3)OC)OC)NC4=CC=NC=C4

InChI

InChI=1S/C21H20N6O3/c1-4-27-19-17(12-23-21(26-19)24-14-5-7-22-8-6-14)25-18(20(27)28)13-9-15(29-2)11-16(10-13)30-3/h5-12H,4H2,1-3H3,(H,22,23,24,26)