2-(5-bromanylpyridin-3-yl)-1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]ethanone

Systemtic Name: 2-(5-bromanylpyridin-3-yl)-1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]ethanone Openeye Name: 2-(5-bromo-3-pyridyl)-1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]ethanone CAS Name: 2-(5-bromo-3-pyridinyl)-1-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-(5-bromopyridin-3-yl)-1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]ethanone Traditional Name: 2-(5-bromo-3-pyridyl)-1-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]ethanone Formula: C18H18BrN3O4S MolecularWeight: 452.32222

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CC3=CC(=CN=C3)Br

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CC3=CC(=CN=C3)Br

InChI

InChI=1S/C18H18BrN3O4S/c1-27(25,26)16-6-3-2-5-15(16)18(24)22-8-4-7-21(22)17(23)10-13-9-14(19)12-20-11-13/h2-3,5-6,9,11-12H,4,7-8,10H2,1H3