N-(3-ethanoylphenyl)-2-(2-methylsulfonylphenyl)carbonyl-pyrazolidine-1-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(2-methylsulfonylphenyl)carbonyl-pyrazolidine-1-carboxamide Openeye Name: N-(3-acetylphenyl)-2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carboxamide CAS Name: N-(3-acetylphenyl)-2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinecarboxamide IUPAC Name: N-(3-acetylphenyl)-2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carboxamide Traditional Name: N-(3-acetylphenyl)-2-(2-mesylbenzoyl)pyrazolidine-1-carboxamide Formula: C20H21N3O5S MolecularWeight: 415.46284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C20H21N3O5S/c1-14(24)15-7-5-8-16(13-15)21-20(26)23-12-6-11-22(23)19(25)17-9-3-4-10-18(17)29(2,27)28/h3-5,7-10,13H,6,11-12H2,1-2H3,(H,21,26)