3-methyl-N-[2-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]butanamide

Systemtic Name: 3-methyl-N-[2-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]butanamide Openeye Name: 3-methyl-N-[2-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-oxo-ethyl]butanamide CAS Name: 3-methyl-N-[2-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]butanamide IUPAC Name: 3-methyl-N-[2-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-oxoethyl]butanamide Traditional Name: N-[2-keto-2-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]ethyl]-3-methyl-butyramide Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NCC(=O)N1CCCN1C(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CC(C)CC(=O)NCC(=O)N1CCCN1C(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C18H25N3O5S/c1-13(2)11-16(22)19-12-17(23)20-9-6-10-21(20)18(24)14-7-4-5-8-15(14)27(3,25)26/h4-5,7-8,13H,6,9-12H2,1-3H3,(H,19,22)