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

Systemtic Name: ethyl 4-[2-(5-oxidanylidene-3-phenethyl-1-phenyl-2-sulfanylidene-imidazolidin-4-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(5-oxo-3-phenethyl-1-phenyl-2-thioxo-imidazolidin-4-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-(5-oxo-3-phenethyl-1-phenyl-2-sulfanylidene-4-imidazolidinyl)ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-oxo-3-phenethyl-1-phenyl-2-sulfanylideneimidazolidin-4-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(5-keto-3-phenethyl-1-phenyl-2-thioxo-imidazolidin-4-yl)acetyl]amino]benzoic acid ethyl ester Formula: C28H27N3O4S MolecularWeight: 501.59668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H27N3O4S/c1-2-35-27(34)21-13-15-22(16-14-21)29-25(32)19-24-26(33)31(23-11-7-4-8-12-23)28(36)30(24)18-17-20-9-5-3-6-10-20/h3-16,24H,2,17-19H2,1H3,(H,29,32)