(4-bromophenyl)-[2-(3-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]methanone

Systemtic Name: (4-bromophenyl)-[2-(3-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]methanone Openeye Name: (4-bromophenyl)-[2-(3-methylsulfonylbenzoyl)pyrazolidin-1-yl]methanone CAS Name: (4-bromophenyl)-[2-[(3-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]methanone IUPAC Name: (4-bromophenyl)-[2-(3-methylsulfonylbenzoyl)pyrazolidin-1-yl]methanone Traditional Name: (4-bromophenyl)-[2-(3-mesylbenzoyl)pyrazolidin-1-yl]methanone Formula: C18H17BrN2O4S MolecularWeight: 437.30758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCCN2C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCCN2C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O4S/c1-26(24,25)16-5-2-4-14(12-16)18(23)21-11-3-10-20(21)17(22)13-6-8-15(19)9-7-13/h2,4-9,12H,3,10-11H2,1H3