5-(4-tert-butylphenyl)-1-phenyl-pyrazole-3-carbonitrile

Systemtic Name: 5-(4-tert-butylphenyl)-1-phenyl-pyrazole-3-carbonitrile Openeye Name: 5-(4-tert-butylphenyl)-1-phenyl-pyrazole-3-carbonitrile CAS Name: 5-(4-tert-butylphenyl)-1-phenyl-3-pyrazolecarbonitrile IUPAC Name: 5-(4-tert-butylphenyl)-1-phenylpyrazole-3-carbonitrile Traditional Name: 5-(4-tert-butylphenyl)-1-phenyl-pyrazole-3-carbonitrile Formula: C20H19N3 MolecularWeight: 301.38496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C#N

InChI

InChI=1S/C20H19N3/c1-20(2,3)16-11-9-15(10-12-16)19-13-17(14-21)22-23(19)18-7-5-4-6-8-18/h4-13H,1-3H3