2-bromanyl-4,5-dimethoxy-N-[(2-morpholin-4-ylpyridin-4-yl)methyl]benzenesulfonamide

Systemtic Name: 2-bromanyl-4,5-dimethoxy-N-[(2-morpholin-4-ylpyridin-4-yl)methyl]benzenesulfonamide Openeye Name: 2-bromo-4,5-dimethoxy-N-[(2-morpholino-4-pyridyl)methyl]benzenesulfonamide CAS Name: 2-bromo-4,5-dimethoxy-N-[[2-(4-morpholinyl)-4-pyridinyl]methyl]benzenesulfonamide IUPAC Name: 2-bromo-4,5-dimethoxy-N-[(2-morpholin-4-ylpyridin-4-yl)methyl]benzenesulfonamide Traditional Name: 2-bromo-4,5-dimethoxy-N-[(2-morpholino-4-pyridyl)methyl]benzenesulfonamide Formula: C18H22BrN3O5S MolecularWeight: 472.35338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)NCC2=CC(=NC=C2)N3CCOCC3

Isomeric SMILES

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)NCC2=CC(=NC=C2)N3CCOCC3

InChI

InChI=1S/C18H22BrN3O5S/c1-25-15-10-14(19)17(11-16(15)26-2)28(23,24)21-12-13-3-4-20-18(9-13)22-5-7-27-8-6-22/h3-4,9-11,21H,5-8,12H2,1-2H3