N-[2-(5-azanyl-4-cyano-pyrazol-1-yl)phenyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide

Systemtic Name: N-[2-(5-azanyl-4-cyano-pyrazol-1-yl)phenyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-[2-(5-amino-4-cyano-pyrazol-1-yl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-[2-(5-amino-4-cyano-1-pyrazolyl)phenyl]-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[2-(5-amino-4-cyanopyrazol-1-yl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: N-[2-(5-amino-4-cyano-pyrazol-1-yl)phenyl]-4-(2-ketopyrrolidino)benzenesulfonamide Formula: C20H18N6O3S MolecularWeight: 422.46032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3N4C(=C(C=N4)C#N)N

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3N4C(=C(C=N4)C#N)N

InChI

InChI=1S/C20H18N6O3S/c21-12-14-13-23-26(20(14)22)18-5-2-1-4-17(18)24-30(28,29)16-9-7-15(8-10-16)25-11-3-6-19(25)27/h1-2,4-5,7-10,13,24H,3,6,11,22H2