2-(2-methylsulfonylphenyl)carbonyl-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide

Systemtic Name: 2-(2-methylsulfonylphenyl)carbonyl-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide Openeye Name: 2-(2-methylsulfonylbenzoyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide CAS Name: 2-[(2-methylsulfonylphenyl)-oxomethyl]-N-(3,4,5-trimethoxyphenyl)-1-pyrazolidinecarboxamide IUPAC Name: 2-(2-methylsulfonylbenzoyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide Traditional Name: 2-(2-mesylbenzoyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide Formula: C21H25N3O7S MolecularWeight: 463.5041

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)N2CCCN2C(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C21H25N3O7S/c1-29-16-12-14(13-17(30-2)19(16)31-3)22-21(26)24-11-7-10-23(24)20(25)15-8-5-6-9-18(15)32(4,27)28/h5-6,8-9,12-13H,7,10-11H2,1-4H3,(H,22,26)