N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-[(4-nitrophenyl)thio]propionamide Formula: C13H16N2O5S2 MolecularWeight: 344.40654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCS(=O)(=O)C1)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1CCS(=O)(=O)C1)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

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