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

Systemtic Name: ethyl 4-[2-[5-oxidanylidene-3-(3-phenylpropyl)-2-sulfanylidene-1-[3-(trifluoromethyl)phenyl]imidazolidin-4-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[5-oxo-3-(3-phenylpropyl)-2-thioxo-1-[3-(trifluoromethyl)phenyl]imidazolidin-4-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[5-oxo-3-(3-phenylpropyl)-2-sulfanylidene-1-[3-(trifluoromethyl)phenyl]-4-imidazolidinyl]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[5-oxo-3-(3-phenylpropyl)-2-sulfanylidene-1-[3-(trifluoromethyl)phenyl]imidazolidin-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[5-keto-3-(3-phenylpropyl)-2-thioxo-1-[3-(trifluoromethyl)phenyl]imidazolidin-4-yl]acetyl]amino]benzoic acid ethyl ester Formula: C30H28F3N3O4S MolecularWeight: 583.62123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCCC3=CC=CC=C3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCCC3=CC=CC=C3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C30H28F3N3O4S/c1-2-40-28(39)21-13-15-23(16-14-21)34-26(37)19-25-27(38)36(24-12-6-11-22(18-24)30(31,32)33)29(41)35(25)17-7-10-20-8-4-3-5-9-20/h3-6,8-9,11-16,18,25H,2,7,10,17,19H2,1H3,(H,34,37)