3-[2-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[2-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one Openeye Name: 3-[2-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-oxo-ethyl]-1,3-benzothiazol-2-one CAS Name: 3-[2-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[2-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-oxoethyl]-1,3-benzothiazol-2-one Traditional Name: 3-[2-keto-2-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]ethyl]-1,3-benzothiazol-2-one Formula: C20H19N3O5S2 MolecularWeight: 445.51196

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CN3C4=CC=CC=C4SC3=O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CN3C4=CC=CC=C4SC3=O

InChI

InChI=1S/C20H19N3O5S2/c1-30(27,28)17-10-5-2-7-14(17)19(25)23-12-6-11-22(23)18(24)13-21-15-8-3-4-9-16(15)29-20(21)26/h2-5,7-10H,6,11-13H2,1H3