4-(5-azanyl-4-cyano-2-oxidanylidene-3H-pyrrol-1-yl)-N-pyridin-2-yl-benzenesulfonamide

Systemtic Name: 4-(5-azanyl-4-cyano-2-oxidanylidene-3H-pyrrol-1-yl)-N-pyridin-2-yl-benzenesulfonamide Openeye Name: 4-(5-amino-4-cyano-2-oxo-3H-pyrrol-1-yl)-N-(2-pyridyl)benzenesulfonamide CAS Name: 4-(5-amino-4-cyano-2-oxo-3H-pyrrol-1-yl)-N-(2-pyridinyl)benzenesulfonamide IUPAC Name: 4-(5-amino-4-cyano-2-oxo-3H-pyrrol-1-yl)-N-pyridin-2-ylbenzenesulfonamide Traditional Name: 4-(2-amino-3-cyano-5-keto-2-pyrrolin-1-yl)-N-(2-pyridyl)benzenesulfonamide Formula: C16H13N5O3S MolecularWeight: 355.37112

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N(C1=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)N)C#N

Isomeric SMILES

C1C(=C(N(C1=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)N)C#N

InChI

InChI=1S/C16H13N5O3S/c17-10-11-9-15(22)21(16(11)18)12-4-6-13(7-5-12)25(23,24)20-14-3-1-2-8-19-14/h1-8H,9,18H2,(H,19,20)