ethyl 4-[2-[1-ethyl-3-(4-oxidanylbutanoylamino)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[1-ethyl-3-(4-oxidanylbutanoylamino)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[1-ethyl-3-(4-hydroxybutanoylamino)-5-oxo-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[1-ethyl-3-[(4-hydroxy-1-oxobutyl)amino]-5-oxo-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[1-ethyl-3-(4-hydroxybutanoylamino)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[1-ethyl-3-(4-hydroxybutanoylamino)-5-keto-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoic acid ethyl ester Formula: C20H26N4O6S MolecularWeight: 450.50864

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(N(C1=S)NC(=O)CCCO)CC(=O)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCN1C(=O)C(N(C1=S)NC(=O)CCCO)CC(=O)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C20H26N4O6S/c1-3-23-18(28)15(24(20(23)31)22-16(26)6-5-11-25)12-17(27)21-14-9-7-13(8-10-14)19(29)30-4-2/h7-10,15,25H,3-6,11-12H2,1-2H3,(H,21,27)(H,22,26)