2-azanyl-N-(4-chlorophenyl)-5-cyano-1-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-6-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 2-azanyl-N-(4-chlorophenyl)-5-cyano-1-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-6-oxidanylidene-pyridine-3-carboxamide Openeye Name: 2-amino-N-(4-chlorophenyl)-5-cyano-4-methylsulfanyl-6-oxo-1-(p-tolylsulfonylamino)pyridine-3-carboxamide CAS Name: 2-amino-N-(4-chlorophenyl)-5-cyano-1-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-6-oxo-3-pyridinecarboxamide IUPAC Name: 2-amino-N-(4-chlorophenyl)-5-cyano-1-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-6-oxopyridine-3-carboxamide Traditional Name: 2-amino-N-(4-chlorophenyl)-5-cyano-6-keto-4-(methylthio)-1-(tosylamino)nicotinamide Formula: C21H18ClN5O4S2 MolecularWeight: 503.98172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN2C(=C(C(=C(C2=O)C#N)SC)C(=O)NC3=CC=C(C=C3)Cl)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NN2C(=C(C(=C(C2=O)C#N)SC)C(=O)NC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C21H18ClN5O4S2/c1-12-3-9-15(10-4-12)33(30,31)26-27-19(24)17(18(32-2)16(11-23)21(27)29)20(28)25-14-7-5-13(22)6-8-14/h3-10,26H,24H2,1-2H3,(H,25,28)