2-bromanyl-5-fluoranyl-N-[3-[methylsulfonyl(pyridin-3-ylmethyl)amino]propyl]benzamide

Systemtic Name: 2-bromanyl-5-fluoranyl-N-[3-[methylsulfonyl(pyridin-3-ylmethyl)amino]propyl]benzamide Openeye Name: 2-bromo-5-fluoro-N-[3-[methylsulfonyl(3-pyridylmethyl)amino]propyl]benzamide CAS Name: 2-bromo-5-fluoro-N-[3-[methylsulfonyl(3-pyridinylmethyl)amino]propyl]benzamide IUPAC Name: 2-bromo-5-fluoro-N-[3-[methylsulfonyl(pyridin-3-ylmethyl)amino]propyl]benzamide Traditional Name: 2-bromo-5-fluoro-N-[3-[mesyl(3-pyridylmethyl)amino]propyl]benzamide Formula: C17H19BrFN3O3S MolecularWeight: 444.318463

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCNC(=O)C1=C(C=CC(=C1)F)Br)CC2=CN=CC=C2

Isomeric SMILES

CS(=O)(=O)N(CCCNC(=O)C1=C(C=CC(=C1)F)Br)CC2=CN=CC=C2

InChI

InChI=1S/C17H19BrFN3O3S/c1-26(24,25)22(12-13-4-2-7-20-11-13)9-3-8-21-17(23)15-10-14(19)5-6-16(15)18/h2,4-7,10-11H,3,8-9,12H2,1H3,(H,21,23)