3-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfonyl-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: 3-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfonyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: 3-(1,1-dioxothiolan-3-yl)sulfonyl-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: 3-[(1,1-dioxo-3-thiolanyl)sulfonyl]-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: 3-(1,1-dioxothiolan-3-yl)sulfonyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 3-(1,1-diketothiolan-3-yl)sulfonyl-N-(3-pyridylmethyl)benzenesulfonamide Formula: C16H18N2O6S3 MolecularWeight: 430.51892

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1CS(=O)(=O)CC1S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C16H18N2O6S3/c19-25(20)8-6-16(12-25)26(21,22)14-4-1-5-15(9-14)27(23,24)18-11-13-3-2-7-17-10-13/h1-5,7,9-10,16,18H,6,8,11-12H2