1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-(3-pyridin-3-ylpyrazol-1-yl)ethanone

Systemtic Name: 1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-(3-pyridin-3-ylpyrazol-1-yl)ethanone Openeye Name: 1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-[3-(3-pyridyl)pyrazol-1-yl]ethanone CAS Name: 1-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-2-[3-(3-pyridinyl)-1-pyrazolyl]ethanone IUPAC Name: 1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-(3-pyridin-3-ylpyrazol-1-yl)ethanone Traditional Name: 1-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]-2-[3-(3-pyridyl)pyrazol-1-yl]ethanone Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CN3C=CC(=N3)C4=CN=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CN3C=CC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C21H21N5O4S/c1-31(29,30)19-8-3-2-7-17(19)21(28)26-12-5-11-25(26)20(27)15-24-13-9-18(23-24)16-6-4-10-22-14-16/h2-4,6-10,13-14H,5,11-12,15H2,1H3