3-[2-(dimethylamino)-8-(2-methoxyethyl)-7-oxidanylidene-pteridin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[2-(dimethylamino)-8-(2-methoxyethyl)-7-oxidanylidene-pteridin-6-yl]benzenecarbonitrile Openeye Name: 3-[2-(dimethylamino)-8-(2-methoxyethyl)-7-oxo-pteridin-6-yl]benzonitrile CAS Name: 3-[2-(dimethylamino)-8-(2-methoxyethyl)-7-oxo-6-pteridinyl]benzonitrile IUPAC Name: 3-[2-(dimethylamino)-8-(2-methoxyethyl)-7-oxopteridin-6-yl]benzonitrile Traditional Name: 3-[2-(dimethylamino)-7-keto-8-(2-methoxyethyl)pteridin-6-yl]benzonitrile Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC(=C3)C#N)CCOC

Isomeric SMILES

CN(C)C1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC(=C3)C#N)CCOC

InChI

InChI=1S/C18H18N6O2/c1-23(2)18-20-11-14-16(22-18)24(7-8-26-3)17(25)15(21-14)13-6-4-5-12(9-13)10-19/h4-6,9,11H,7-8H2,1-3H3