3-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: 3-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: 3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)sulfanyl]-N-(4-sulfamoylphenyl)propanamide CAS Name: 3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridinyl)thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 3-(6-amino-3,5-dicyano-4-phenylpyridin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: 3-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)thio]-N-(4-sulfamoylphenyl)propionamide Formula: C22H18N6O3S2 MolecularWeight: 478.54672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N6O3S2/c23-12-17-20(14-4-2-1-3-5-14)18(13-24)22(28-21(17)25)32-11-10-19(29)27-15-6-8-16(9-7-15)33(26,30)31/h1-9H,10-11H2,(H2,25,28)(H,27,29)(H2,26,30,31)