methyl 2-[2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]carbothioylsulfanylethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]carbothioylsulfanylethanoylamino]benzoate Openeye Name: methyl 2-[[2-(2,5-dioxopyrrolidine-1-carbothioyl)sulfanylacetyl]amino]benzoate CAS Name: 2-[[2-[[(2,5-dioxo-1-pyrrolidinyl)-sulfanylidenemethyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(2,5-dioxopyrrolidine-1-carbothioyl)sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[(2,5-diketopyrrolidine-1-carbothioyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C15H14N2O5S2 MolecularWeight: 366.41206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC(=S)N2C(=O)CCC2=O

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC(=S)N2C(=O)CCC2=O

InChI

InChI=1S/C15H14N2O5S2/c1-22-14(21)9-4-2-3-5-10(9)16-11(18)8-24-15(23)17-12(19)6-7-13(17)20/h2-5H,6-8H2,1H3,(H,16,18)