3-[2-(ethylamino)-8-[(3-methoxyphenyl)methyl]-7-oxidanylidene-pteridin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[2-(ethylamino)-8-[(3-methoxyphenyl)methyl]-7-oxidanylidene-pteridin-6-yl]benzenecarbonitrile Openeye Name: 3-[2-(ethylamino)-8-[(3-methoxyphenyl)methyl]-7-oxo-pteridin-6-yl]benzonitrile CAS Name: 3-[2-(ethylamino)-8-[(3-methoxyphenyl)methyl]-7-oxo-6-pteridinyl]benzonitrile IUPAC Name: 3-[2-(ethylamino)-8-[(3-methoxyphenyl)methyl]-7-oxopteridin-6-yl]benzonitrile Traditional Name: 3-[2-(ethylamino)-7-keto-8-m-anisyl-pteridin-6-yl]benzonitrile Formula: C23H20N6O2 MolecularWeight: 412.4439

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC(=C3)C#N)CC4=CC(=CC=C4)OC

Isomeric SMILES

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC(=C3)C#N)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C23H20N6O2/c1-3-25-23-26-13-19-21(28-23)29(14-16-7-5-9-18(11-16)31-2)22(30)20(27-19)17-8-4-6-15(10-17)12-24/h4-11,13H,3,14H2,1-2H3,(H,25,26,28)