3-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide

Systemtic Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-[4-(2-pyridylsulfamoyl)phenyl]propanamide CAS Name: 3-[[3-cyano-4-(4-methylphenyl)-6-phenyl-2-pyridinyl]thio]-N-[4-(2-pyridinylsulfamoyl)phenyl]propanamide IUPAC Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]thio]-N-[4-(2-pyridylsulfamoyl)phenyl]propionamide Formula: C33H27N5O3S2 MolecularWeight: 605.72918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=N4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=N4)C5=CC=CC=C5

InChI

InChI=1S/C33H27N5O3S2/c1-23-10-12-24(13-11-23)28-21-30(25-7-3-2-4-8-25)37-33(29(28)22-34)42-20-18-32(39)36-26-14-16-27(17-15-26)43(40,41)38-31-9-5-6-19-35-31/h2-17,19,21H,18,20H2,1H3,(H,35,38)(H,36,39)