3-bromanyl-N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Openeye Name: 3-bromo-N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide CAS Name: 3-bromo-N-[1-[3-(4-cyanophenyl)-1-oxopropyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide IUPAC Name: 3-bromo-N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Traditional Name: 3-bromo-N-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Formula: C25H22BrN3O3S MolecularWeight: 524.42948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=CC=C3)Br)N(C1)C(=O)CCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=CC=C3)Br)N(C1)C(=O)CCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H22BrN3O3S/c26-21-4-1-5-23(16-21)33(31,32)28-22-11-12-24-20(15-22)3-2-14-29(24)25(30)13-10-18-6-8-19(17-27)9-7-18/h1,4-9,11-12,15-16,28H,2-3,10,13-14H2