N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenyl-pyrazol-3-yl]benzamide

Systemtic Name: N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenyl-pyrazol-3-yl]benzamide Openeye Name: N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenyl-pyrazol-3-yl]benzamide CAS Name: N-[5-[(2-chlorophenyl)methylthio]-4-cyano-2-phenyl-3-pyrazolyl]benzamide IUPAC Name: N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenylpyrazol-3-yl]benzamide Traditional Name: N-[5-[(2-chlorobenzyl)thio]-4-cyano-2-phenyl-pyrazol-3-yl]benzamide Formula: C24H17ClN4OS MolecularWeight: 444.93598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C(C(=NN2C3=CC=CC=C3)SCC4=CC=CC=C4Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C(C(=NN2C3=CC=CC=C3)SCC4=CC=CC=C4Cl)C#N

InChI

InChI=1S/C24H17ClN4OS/c25-21-14-8-7-11-18(21)16-31-24-20(15-26)22(27-23(30)17-9-3-1-4-10-17)29(28-24)19-12-5-2-6-13-19/h1-14H,16H2,(H,27,30)