5-bromanyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[[2-(morpholinosulfonylmethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[[2-(4-morpholinylsulfonylmethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[2-(morpholinosulfonylmethyl)benzyl]nicotinamide Formula: C18H20BrN3O4S MolecularWeight: 454.3381

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)CC2=CC=CC=C2CNC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)CC2=CC=CC=C2CNC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C18H20BrN3O4S/c19-17-9-16(10-20-12-17)18(23)21-11-14-3-1-2-4-15(14)13-27(24,25)22-5-7-26-8-6-22/h1-4,9-10,12H,5-8,11,13H2,(H,21,23)