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

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(4-sulfamoylphenyl)propanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(4-methylphenyl)-2-pyridinyl]thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]thio]-N-(4-sulfamoylphenyl)propionamide Formula: C23H20N6O3S2 MolecularWeight: 492.5733

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N)N)C#N

InChI

InChI=1S/C23H20N6O3S2/c1-13-3-5-15(6-4-13)20-18(11-24)21(26)29-23(19(20)12-25)33-14(2)22(30)28-16-7-9-17(10-8-16)34(27,31)32/h3-10,14H,1-2H3,(H2,26,29)(H,28,30)(H2,27,31,32)