4-[[4-[[(2Z)-7-methyl-3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl]oxy]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[[(2Z)-7-methyl-3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl]oxy]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-[(2Z)-7-methyl-3-oxo-2-(3-pyridylmethylene)benzofuran-6-yl]oxypyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-[[(2Z)-7-methyl-3-oxo-2-(3-pyridinylmethylidene)-6-benzofuranyl]oxy]-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-[[(2Z)-7-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl]oxy]pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-[(2Z)-3-keto-7-methyl-2-(3-pyridylmethylene)coumaran-6-yl]oxypyrimidin-2-yl]amino]benzonitrile Formula: C26H17N5O3 MolecularWeight: 447.44488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=CC3=CN=CC=C3)C2=O)OC4=NC(=NC=C4)NC5=CC=C(C=C5)C#N

Isomeric SMILES

CC1=C(C=CC2=C1O/C(=C\C3=CN=CC=C3)/C2=O)OC4=NC(=NC=C4)NC5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H17N5O3/c1-16-21(9-8-20-24(32)22(34-25(16)20)13-18-3-2-11-28-15-18)33-23-10-12-29-26(31-23)30-19-6-4-17(14-27)5-7-19/h2-13,15H,1H3,(H,29,30,31)/b22-13-