N-(2-acetamidoethyl)-4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfonyl-benzamide

Systemtic Name: N-(2-acetamidoethyl)-4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfonyl-benzamide Openeye Name: N-(2-acetamidoethyl)-4-[(3S)-1,1-dioxothiolan-3-yl]sulfonyl-benzamide CAS Name: N-(2-acetamidoethyl)-4-[[(3S)-1,1-dioxo-3-thiolanyl]sulfonyl]benzamide IUPAC Name: N-(2-acetamidoethyl)-4-[(3S)-1,1-dioxothiolan-3-yl]sulfonylbenzamide Traditional Name: N-(2-acetamidoethyl)-4-[(3S)-1,1-diketothiolan-3-yl]sulfonyl-benzamide Formula: C15H20N2O6S2 MolecularWeight: 388.4591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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