1-(4-fluoranyl-2-nitro-phenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile

Systemtic Name: 1-(4-fluoranyl-2-nitro-phenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile Openeye Name: 1-(4-fluoro-2-nitro-phenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile CAS Name: 1-(4-fluoro-2-nitrophenyl)-5-(4-methylsulfonylphenyl)-3-pyrazolecarbonitrile IUPAC Name: 1-(4-fluoro-2-nitrophenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile Traditional Name: 1-(4-fluoro-2-nitro-phenyl)-5-(4-mesylphenyl)pyrazole-3-carbonitrile Formula: C17H11FN4O4S MolecularWeight: 386.357043

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3=C(C=C(C=C3)F)[N+](=O)[O-])C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3=C(C=C(C=C3)F)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H11FN4O4S/c1-27(25,26)14-5-2-11(3-6-14)16-9-13(10-19)20-21(16)15-7-4-12(18)8-17(15)22(23)24/h2-9H,1H3