1-[2-(4-bromophenyl)carbonylpyrazolidin-1-yl]-2-(4-methylphenyl)sulfonyl-ethanone

Systemtic Name: 1-[2-(4-bromophenyl)carbonylpyrazolidin-1-yl]-2-(4-methylphenyl)sulfonyl-ethanone Openeye Name: 1-[2-(4-bromobenzoyl)pyrazolidin-1-yl]-2-(p-tolylsulfonyl)ethanone CAS Name: 1-[2-[(4-bromophenyl)-oxomethyl]-1-pyrazolidinyl]-2-(4-methylphenyl)sulfonylethanone IUPAC Name: 1-[2-(4-bromobenzoyl)pyrazolidin-1-yl]-2-(4-methylphenyl)sulfonylethanone Traditional Name: 1-[2-(4-bromobenzoyl)pyrazolidin-1-yl]-2-tosyl-ethanone Formula: C19H19BrN2O4S MolecularWeight: 451.33416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2CCCN2C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2CCCN2C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H19BrN2O4S/c1-14-3-9-17(10-4-14)27(25,26)13-18(23)21-11-2-12-22(21)19(24)15-5-7-16(20)8-6-15/h3-10H,2,11-13H2,1H3