1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-3-pyridin-3-yl-propan-1-one

Systemtic Name: 1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-3-pyridin-3-yl-propan-1-one Openeye Name: 1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-3-(3-pyridyl)propan-1-one CAS Name: 1-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-3-(3-pyridinyl)-1-propanone IUPAC Name: 1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-3-pyridin-3-ylpropan-1-one Traditional Name: 1-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]-3-(3-pyridyl)propan-1-one Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CCC3=CN=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C19H21N3O4S/c1-27(25,26)17-8-3-2-7-16(17)19(24)22-13-5-12-21(22)18(23)10-9-15-6-4-11-20-14-15/h2-4,6-8,11,14H,5,9-10,12-13H2,1H3