4-chloranyl-N-(1-pyridin-3-ylcarbonyl-3,4-dihydro-2H-quinolin-6-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(1-pyridin-3-ylcarbonyl-3,4-dihydro-2H-quinolin-6-yl)benzenesulfonamide Openeye Name: 4-chloro-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide CAS Name: 4-chloro-N-[1-[oxo(3-pyridinyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Traditional Name: 4-chloro-N-(1-nicotinoyl-3,4-dihydro-2H-quinolin-6-yl)benzenesulfonamide Formula: C21H18ClN3O3S MolecularWeight: 427.90392

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)N(C1)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)N(C1)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H18ClN3O3S/c22-17-5-8-19(9-6-17)29(27,28)24-18-7-10-20-15(13-18)4-2-12-25(20)21(26)16-3-1-11-23-14-16/h1,3,5-11,13-14,24H,2,4,12H2