3-[3-(3,5-dimethylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]benzenecarbonitrile

Systemtic Name: 3-[3-(3,5-dimethylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]benzenecarbonitrile Openeye Name: 3-[3-(3,5-dimethylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]benzonitrile CAS Name: 3-[3-(3,5-dimethylphenyl)-7-pyrazolo[1,5-a]pyrimidinyl]benzonitrile IUPAC Name: 3-[3-(3,5-dimethylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]benzonitrile Traditional Name: 3-[3-(3,5-dimethylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]benzonitrile Formula: C21H16N4 MolecularWeight: 324.37854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C3N=CC=C(N3N=C2)C4=CC=CC(=C4)C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C3N=CC=C(N3N=C2)C4=CC=CC(=C4)C#N)C

InChI

InChI=1S/C21H16N4/c1-14-8-15(2)10-18(9-14)19-13-24-25-20(6-7-23-21(19)25)17-5-3-4-16(11-17)12-22/h3-11,13H,1-2H3