5-(2-fluoranyl-4,5-dimethyl-phenyl)-4-methyl-2-prop-2-ynyl-pyrazole-3-carbonitrile

Systemtic Name: 5-(2-fluoranyl-4,5-dimethyl-phenyl)-4-methyl-2-prop-2-ynyl-pyrazole-3-carbonitrile Openeye Name: 5-(2-fluoro-4,5-dimethyl-phenyl)-4-methyl-2-prop-2-ynyl-pyrazole-3-carbonitrile CAS Name: 5-(2-fluoro-4,5-dimethylphenyl)-4-methyl-2-prop-2-ynyl-3-pyrazolecarbonitrile IUPAC Name: 5-(2-fluoro-4,5-dimethylphenyl)-4-methyl-2-prop-2-ynylpyrazole-3-carbonitrile Traditional Name: 5-(2-fluoro-4,5-dimethyl-phenyl)-4-methyl-2-propargyl-pyrazole-3-carbonitrile Formula: C16H14FN3 MolecularWeight: 267.300863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2=NN(C(=C2C)C#N)CC#C)F)C

Isomeric SMILES

CC1=C(C=C(C(=C1)C2=NN(C(=C2C)C#N)CC#C)F)C

InChI

InChI=1S/C16H14FN3/c1-5-6-20-15(9-18)12(4)16(19-20)13-7-10(2)11(3)8-14(13)17/h1,7-8H,6H2,2-4H3