methyl 4-[2-[(4S)-1-ethyl-3-(furan-2-ylmethyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(4S)-1-ethyl-3-(furan-2-ylmethyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(4S)-1-ethyl-3-(2-furylmethyl)-5-oxo-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[(4S)-1-ethyl-3-(2-furanylmethyl)-5-oxo-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(4S)-1-ethyl-3-(furan-2-ylmethyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(4S)-1-ethyl-3-(2-furfuryl)-5-keto-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoic acid methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(N(C1=S)CC2=CC=CO2)CC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCN1C(=O)[C@@H](N(C1=S)CC2=CC=CO2)CC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H21N3O5S/c1-3-22-18(25)16(23(20(22)29)12-15-5-4-10-28-15)11-17(24)21-14-8-6-13(7-9-14)19(26)27-2/h4-10,16H,3,11-12H2,1-2H3,(H,21,24)/t16-/m0/s1