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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27N3O4S/c1-35-27(34)21-14-16-22(17-15-21)29-25(32)19-24-26(33)31(23-12-6-3-7-13-23)28(36)30(24)18-8-11-20-9-4-2-5-10-20/h2-7,9-10,12-17,24H,8,11,18-19H2,1H3,(H,29,32)