2-[2-(4-methylsulfonylphenyl)ethanoyl]-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide

Systemtic Name: 2-[2-(4-methylsulfonylphenyl)ethanoyl]-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide Openeye Name: 2-[2-(4-methylsulfonylphenyl)acetyl]-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide CAS Name: 2-[2-(4-methylsulfonylphenyl)-1-oxoethyl]-N-(3,4,5-trimethoxyphenyl)-1-pyrazolidinecarboxamide IUPAC Name: 2-[2-(4-methylsulfonylphenyl)acetyl]-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide Traditional Name: 2-[2-(4-mesylphenyl)acetyl]-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carboxamide Formula: C22H27N3O7S MolecularWeight: 477.53068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)N2CCCN2C(=O)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)N2CCCN2C(=O)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H27N3O7S/c1-30-18-13-16(14-19(31-2)21(18)32-3)23-22(27)25-11-5-10-24(25)20(26)12-15-6-8-17(9-7-15)33(4,28)29/h6-9,13-14H,5,10-12H2,1-4H3,(H,23,27)