1-[[2,4-bis(fluoranyl)phenyl]methyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]methyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile Openeye Name: 1-[(2,4-difluorophenyl)methyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile CAS Name: 1-[(2,4-difluorophenyl)methyl]-5-(4-methylsulfonylphenyl)-3-pyrazolecarbonitrile IUPAC Name: 1-[(2,4-difluorophenyl)methyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile Traditional Name: 1-(2,4-difluorobenzyl)-5-(4-mesylphenyl)pyrazole-3-carbonitrile Formula: C18H13F2N3O2S MolecularWeight: 373.376526

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2CC3=C(C=C(C=C3)F)F)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2CC3=C(C=C(C=C3)F)F)C#N

InChI

InChI=1S/C18H13F2N3O2S/c1-26(24,25)16-6-3-12(4-7-16)18-9-15(10-21)22-23(18)11-13-2-5-14(19)8-17(13)20/h2-9H,11H2,1H3