2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfanyl-N-(2-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfanyl-N-(2-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[(3S)-1,1-dioxothiolan-3-yl]sulfanyl-N-(2-methyl-3-nitro-phenyl)acetamide CAS Name: 2-[[(3S)-1,1-dioxo-3-thiolanyl]thio]-N-(2-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-[(3S)-1,1-dioxothiolan-3-yl]sulfanyl-N-(2-methyl-3-nitrophenyl)acetamide Traditional Name: 2-[[(3S)-1,1-diketothiolan-3-yl]thio]-N-(2-methyl-3-nitro-phenyl)acetamide Formula: C13H16N2O5S2 MolecularWeight: 344.40654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CSC2CCS(=O)(=O)C2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CS[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C13H16N2O5S2/c1-9-11(3-2-4-12(9)15(17)18)14-13(16)7-21-10-5-6-22(19,20)8-10/h2-4,10H,5-8H2,1H3,(H,14,16)/t10-/m0/s1