2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]propanamide

Systemtic Name: 2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]propanamide Openeye Name: 2-[(3-cyano-4,6-diphenyl-2-pyridyl)sulfanyl]-N-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]propanamide CAS Name: 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]-N-[4-[(5-methyl-3-isoxazolyl)sulfamoyl]phenyl]propanamide IUPAC Name: 2-(3-cyano-4,6-diphenylpyridin-2-yl)sulfanyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]propanamide Traditional Name: 2-[(3-cyano-4,6-diphenyl-2-pyridyl)thio]-N-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]propionamide Formula: C31H25N5O4S2 MolecularWeight: 595.6913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C(C)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C(C)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C31H25N5O4S2/c1-20-17-29(35-40-20)36-42(38,39)25-15-13-24(14-16-25)33-30(37)21(2)41-31-27(19-32)26(22-9-5-3-6-10-22)18-28(34-31)23-11-7-4-8-12-23/h3-18,21H,1-2H3,(H,33,37)(H,35,36)