5-tert-butyl-4-methyl-1-phenyl-pyrazole-3-carbonitrile

Systemtic Name: 5-tert-butyl-4-methyl-1-phenyl-pyrazole-3-carbonitrile Openeye Name: 5-tert-butyl-4-methyl-1-phenyl-pyrazole-3-carbonitrile CAS Name: 5-tert-butyl-4-methyl-1-phenyl-3-pyrazolecarbonitrile IUPAC Name: 5-tert-butyl-4-methyl-1-phenylpyrazole-3-carbonitrile Traditional Name: 5-tert-butyl-4-methyl-1-phenyl-pyrazole-3-carbonitrile Formula: C15H17N3 MolecularWeight: 239.31558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C#N)C2=CC=CC=C2)C(C)(C)C

Isomeric SMILES

CC1=C(N(N=C1C#N)C2=CC=CC=C2)C(C)(C)C

InChI

InChI=1S/C15H17N3/c1-11-13(10-16)17-18(14(11)15(2,3)4)12-8-6-5-7-9-12/h5-9H,1-4H3