methyl 4-[[2-oxidanylidene-2-[(2-oxidanylidenethiolan-3-yl)amino]ethanoyl]amino]benzoate

Systemtic Name: methyl 4-[[2-oxidanylidene-2-[(2-oxidanylidenethiolan-3-yl)amino]ethanoyl]amino]benzoate Openeye Name: methyl 4-[[2-oxo-2-[(2-oxotetrahydrothiophen-3-yl)amino]acetyl]amino]benzoate CAS Name: 4-[[1,2-dioxo-2-[(2-oxo-3-thiolanyl)amino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-oxo-2-[(2-oxothiolan-3-yl)amino]acetyl]amino]benzoate Traditional Name: 4-[[2-keto-2-[(2-ketotetrahydrothiophen-3-yl)amino]acetyl]amino]benzoic acid methyl ester Formula: C14H14N2O5S MolecularWeight: 322.33636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NC2CCSC2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NC2CCSC2=O

InChI

InChI=1S/C14H14N2O5S/c1-21-13(19)8-2-4-9(5-3-8)15-11(17)12(18)16-10-6-7-22-14(10)20/h2-5,10H,6-7H2,1H3,(H,15,17)(H,16,18)