1-[4-fluoranyl-2-(methylamino)phenyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile

Systemtic Name: 1-[4-fluoranyl-2-(methylamino)phenyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile Openeye Name: 1-[4-fluoro-2-(methylamino)phenyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile CAS Name: 1-[4-fluoro-2-(methylamino)phenyl]-5-(4-methylsulfonylphenyl)-3-pyrazolecarbonitrile IUPAC Name: 1-[4-fluoro-2-(methylamino)phenyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile Traditional Name: 1-[4-fluoro-2-(methylamino)phenyl]-5-(4-mesylphenyl)pyrazole-3-carbonitrile Formula: C18H15FN4O2S MolecularWeight: 370.400703

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC(=C1)F)N2C(=CC(=N2)C#N)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CNC1=C(C=CC(=C1)F)N2C(=CC(=N2)C#N)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H15FN4O2S/c1-21-16-9-13(19)5-8-17(16)23-18(10-14(11-20)22-23)12-3-6-15(7-4-12)26(2,24)25/h3-10,21H,1-2H3