N-[(3S)-6-cyano-1-(pyridin-2-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide

Systemtic Name: N-[(3S)-6-cyano-1-(pyridin-2-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide Openeye Name: N-[(3S)-6-cyano-1-(2-pyridylmethyl)-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide CAS Name: N-[(3S)-6-cyano-1-(2-pyridinylmethyl)-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide IUPAC Name: N-[(3S)-6-cyano-1-(pyridin-2-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide Traditional Name: N-[(3S)-6-cyano-1-(2-pyridylmethyl)-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide Formula: C22H20N4O2S MolecularWeight: 404.4848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C2=C1C=C(C=C2)C#N)CC3=CC=CC=N3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](CN(C2=C1C=C(C=C2)C#N)CC3=CC=CC=N3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2S/c23-14-17-9-10-22-18(12-17)13-20(16-26(22)15-19-6-4-5-11-24-19)25-29(27,28)21-7-2-1-3-8-21/h1-12,20,25H,13,15-16H2/t20-/m0/s1