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

Systemtic Name: ethyl 4-[2-[1-ethyl-5-oxidanylidene-2-sulfanylidene-3-(thiophen-2-ylcarbonylamino)imidazolidin-4-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[1-ethyl-5-oxo-3-(thiophene-2-carbonylamino)-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[1-ethyl-5-oxo-3-[[oxo(thiophen-2-yl)methyl]amino]-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[1-ethyl-5-oxo-2-sulfanylidene-3-(thiophene-2-carbonylamino)imidazolidin-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[1-ethyl-5-keto-3-(2-thenoylamino)-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoic acid ethyl ester Formula: C21H22N4O5S2 MolecularWeight: 474.55318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(N(C1=S)NC(=O)C2=CC=CS2)CC(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCN1C(=O)C(N(C1=S)NC(=O)C2=CC=CS2)CC(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C21H22N4O5S2/c1-3-24-19(28)15(25(21(24)31)23-18(27)16-6-5-11-32-16)12-17(26)22-14-9-7-13(8-10-14)20(29)30-4-2/h5-11,15H,3-4,12H2,1-2H3,(H,22,26)(H,23,27)