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

Systemtic Name: N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenyl-pyrazol-3-yl]-3-phenyl-prop-2-enamide Openeye Name: N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenyl-pyrazol-3-yl]-3-phenyl-prop-2-enamide CAS Name: N-[5-[(2-chlorophenyl)methylthio]-4-cyano-2-phenyl-3-pyrazolyl]-3-phenyl-2-propenamide IUPAC Name: N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenylpyrazol-3-yl]-3-phenylprop-2-enamide Traditional Name: N-[5-[(2-chlorobenzyl)thio]-4-cyano-2-phenyl-pyrazol-3-yl]-3-phenyl-acrylamide Formula: C26H19ClN4OS MolecularWeight: 470.97326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H19ClN4OS/c27-23-14-8-7-11-20(23)18-33-26-22(17-28)25(31(30-26)21-12-5-2-6-13-21)29-24(32)16-15-19-9-3-1-4-10-19/h1-16H,18H2,(H,29,32)