N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-4-yl]-4-cyano-benzamide

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-4-yl]-4-cyano-benzamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-4-yl]-4-cyano-benzamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-4-pyrazolyl]-4-cyanobenzamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-4-yl]-4-cyanobenzamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)pyrazol-4-yl]-4-cyano-benzamide Formula: C18H12ClFN4O MolecularWeight: 354.765483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN2C=C(C=N2)NC(=O)C3=CC=C(C=C3)C#N)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN2C=C(C=N2)NC(=O)C3=CC=C(C=C3)C#N)F

InChI

InChI=1S/C18H12ClFN4O/c19-16-2-1-3-17(20)15(16)11-24-10-14(9-22-24)23-18(25)13-6-4-12(8-21)5-7-13/h1-7,9-10H,11H2,(H,23,25)