N-(3-acetamido-2-methyl-phenyl)-2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanyl-benzamide

Systemtic Name: N-(3-acetamido-2-methyl-phenyl)-2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanyl-benzamide Openeye Name: N-(3-acetamido-2-methyl-phenyl)-2-(1,1-dioxothiolan-3-yl)sulfanyl-benzamide CAS Name: N-(3-acetamido-2-methylphenyl)-2-[(1,1-dioxo-3-thiolanyl)thio]benzamide IUPAC Name: N-(3-acetamido-2-methylphenyl)-2-(1,1-dioxothiolan-3-yl)sulfanylbenzamide Traditional Name: N-(3-acetamido-2-methyl-phenyl)-2-[(1,1-diketothiolan-3-yl)thio]benzamide Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C)NC(=O)C2=CC=CC=C2SC3CCS(=O)(=O)C3

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C)NC(=O)C2=CC=CC=C2SC3CCS(=O)(=O)C3

InChI

InChI=1S/C20H22N2O4S2/c1-13-17(21-14(2)23)7-5-8-18(13)22-20(24)16-6-3-4-9-19(16)27-15-10-11-28(25,26)12-15/h3-9,15H,10-12H2,1-2H3,(H,21,23)(H,22,24)