N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-2-methoxy-4,5-dimethyl-benzenesulfonamide

Systemtic Name: N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-2-methoxy-4,5-dimethyl-benzenesulfonamide Openeye Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-2-methoxy-4,5-dimethyl-benzenesulfonamide CAS Name: N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-2-methoxy-4,5-dimethylbenzenesulfonamide IUPAC Name: N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-2-methoxy-4,5-dimethylbenzenesulfonamide Traditional Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-2-methoxy-4,5-dimethyl-benzenesulfonamide Formula: C22H19N5O3S MolecularWeight: 433.48296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C=C3)C#N)OC

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C=C3)C#N)OC

InChI

InChI=1S/C22H19N5O3S/c1-14-10-19(30-3)20(11-15(14)2)31(28,29)26-22-17(12-23)13-24-27(22)21-9-8-16-6-4-5-7-18(16)25-21/h4-11,13,26H,1-3H3