N-(2-acetamidoethyl)-3-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfonyl-benzamide

Systemtic Name: N-(2-acetamidoethyl)-3-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfonyl-benzamide Openeye Name: N-(2-acetamidoethyl)-3-[(3S)-1,1-dioxothiolan-3-yl]sulfonyl-benzamide CAS Name: N-(2-acetamidoethyl)-3-[[(3S)-1,1-dioxo-3-thiolanyl]sulfonyl]benzamide IUPAC Name: N-(2-acetamidoethyl)-3-[(3S)-1,1-dioxothiolan-3-yl]sulfonylbenzamide Traditional Name: N-(2-acetamidoethyl)-3-[(3S)-1,1-diketothiolan-3-yl]sulfonyl-benzamide Formula: C15H20N2O6S2 MolecularWeight: 388.4591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)C2CCS(=O)(=O)C2

Isomeric SMILES

CC(=O)NCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C15H20N2O6S2/c1-11(18)16-6-7-17-15(19)12-3-2-4-13(9-12)25(22,23)14-5-8-24(20,21)10-14/h2-4,9,14H,5-8,10H2,1H3,(H,16,18)(H,17,19)/t14-/m0/s1