4-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-4-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 4-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-4-oxidanylidene-N-phenyl-butanamide Openeye Name: 4-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-4-oxo-N-phenyl-butanamide CAS Name: 4-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-4-oxo-N-phenylbutanamide IUPAC Name: 4-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-4-oxo-N-phenylbutanamide Traditional Name: 4-keto-4-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]-N-phenyl-butyramide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O5S/c1-30(28,29)18-11-6-5-10-17(18)21(27)24-15-7-14-23(24)20(26)13-12-19(25)22-16-8-3-2-4-9-16/h2-6,8-11H,7,12-15H2,1H3,(H,22,25)