4-[[4-[4-[(E)-2-cyanoprop-1-enyl]-2-methyl-phenoxy]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[4-[(E)-2-cyanoprop-1-enyl]-2-methyl-phenoxy]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-[4-[(E)-2-cyanoprop-1-enyl]-2-methyl-phenoxy]pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-[4-[(E)-2-cyanoprop-1-enyl]-2-methylphenoxy]-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-[4-[(E)-2-cyanoprop-1-enyl]-2-methylphenoxy]pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-[4-[(E)-2-cyanoprop-1-enyl]-2-methyl-phenoxy]pyrimidin-2-yl]amino]benzonitrile Formula: C22H17N5O MolecularWeight: 367.40328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=C(C)C#N)OC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)/C=C(\C)/C#N)OC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H17N5O/c1-15(13-23)11-18-5-8-20(16(2)12-18)28-21-9-10-25-22(27-21)26-19-6-3-17(14-24)4-7-19/h3-12H,1-2H3,(H,25,26,27)/b15-11+