4-[[4-[[3-(1H-pyrrol-3-ylmethyl)-1-benzofuran-6-yl]oxy]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[[3-(1H-pyrrol-3-ylmethyl)-1-benzofuran-6-yl]oxy]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-[3-(1H-pyrrol-3-ylmethyl)benzofuran-6-yl]oxypyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-[[3-(1H-pyrrol-3-ylmethyl)-6-benzofuranyl]oxy]-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-[[3-(1H-pyrrol-3-ylmethyl)-1-benzofuran-6-yl]oxy]pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-[3-(1H-pyrrol-3-ylmethyl)benzofuran-6-yl]oxypyrimidin-2-yl]amino]benzonitrile Formula: C24H17N5O2 MolecularWeight: 407.42408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC2=NC=CC(=N2)OC3=CC4=C(C=C3)C(=CO4)CC5=CNC=C5

Isomeric SMILES

C1=CC(=CC=C1C#N)NC2=NC=CC(=N2)OC3=CC4=C(C=C3)C(=CO4)CC5=CNC=C5

InChI

InChI=1S/C24H17N5O2/c25-13-16-1-3-19(4-2-16)28-24-27-10-8-23(29-24)31-20-5-6-21-18(15-30-22(21)12-20)11-17-7-9-26-14-17/h1-10,12,14-15,26H,11H2,(H,27,28,29)