N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-4-oxidanyl-1,1-bis(oxidanylidene)thiolane-3-sulfonamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-4-oxidanyl-1,1-bis(oxidanylidene)thiolane-3-sulfonamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-4-hydroxy-1,1-dioxo-thiolane-3-sulfonamide CAS Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-4-hydroxy-1,1-dioxo-3-thiolanesulfonamide IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-ylethyl]-4-hydroxy-1,1-dioxothiolane-3-sulfonamide Traditional Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-4-hydroxy-1,1-diketo-thiolane-3-sulfonamide Formula: C19H24N2O7S3 MolecularWeight: 488.59806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C(CNS(=O)(=O)C2CS(=O)(=O)CC2O)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C(CNS(=O)(=O)C2CS(=O)(=O)CC2O)C3=CN=CC=C3)C

InChI

InChI=1S/C19H24N2O7S3/c1-13-5-6-16(8-14(13)2)30(25,26)18(15-4-3-7-20-9-15)10-21-31(27,28)19-12-29(23,24)11-17(19)22/h3-9,17-19,21-22H,10-12H2,1-2H3