3-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-phenoxy-benzenecarbonitrile

Systemtic Name: 3-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-phenoxy-benzenecarbonitrile Openeye Name: 3-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-phenoxy-benzonitrile CAS Name: 3-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-phenoxybenzonitrile IUPAC Name: 3-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-phenoxybenzonitrile Traditional Name: 3-[[6-keto-2-[3-(1-methyl-2-imidazolin-2-yl)phenoxy]-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-phenoxy-benzonitrile Formula: C29H23N7O4 MolecularWeight: 533.53742

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C1C2=CC(=CC=C2)OC3=NC4=C(C(=N3)OC5=C(C=CC(=C5)C#N)OC6=CC=CC=C6)NC(=O)CN4

Isomeric SMILES

CN1CCN=C1C2=CC(=CC=C2)OC3=NC4=C(C(=N3)OC5=C(C=CC(=C5)C#N)OC6=CC=CC=C6)NC(=O)CN4

InChI

InChI=1S/C29H23N7O4/c1-36-13-12-31-27(36)19-6-5-9-21(15-19)39-29-34-26-25(33-24(37)17-32-26)28(35-29)40-23-14-18(16-30)10-11-22(23)38-20-7-3-2-4-8-20/h2-11,14-15H,12-13,17H2,1H3,(H,33,37)(H,32,34,35)