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4-[[4-[cyano-(3,5-dimethylphenyl)methyl]pyrimidin-2-yl]amino]benzenecarbonitrile

4-[[4-[cyano-(3,5-dimethylphenyl)methyl]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name:4-[[4-[cyano-(3,5-dimethylphenyl)methyl]pyrimidin-2-yl]amino]benzenecarbonitrile
Openeye Name:4-[[4-[cyano-(3,5-dimethylphenyl)methyl]pyrimidin-2-yl]amino]benzonitrile
CAS Name:4-[[4-[cyano-(3,5-dimethylphenyl)methyl]-2-pyrimidinyl]amino]benzonitrile
IUPAC Name:4-[[4-[cyano-(3,5-dimethylphenyl)methyl]pyrimidin-2-yl]amino]benzonitrile
Traditional Name:4-[[4-[cyano-(3,5-dimethylphenyl)methyl]pyrimidin-2-yl]amino]benzonitrile
Formula: C21H17N5
MolecularWeight: 339.39318
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H17N5/c1-14-9-15(2)11-17(10-14)19(13-23)20-7-8-24-21(26-20)25-18-5-3-16(12-22)4-6-18/h3-11,19H,1-2H3,(H,24,25,26)


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