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

Systemtic Name: ethyl 4-[2-[1-(4-ethoxycarbonylphenyl)-3-heptyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[1-(4-ethoxycarbonylphenyl)-3-heptyl-5-oxo-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[1-(4-ethoxycarbonylphenyl)-3-heptyl-5-oxo-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[1-(4-ethoxycarbonylphenyl)-3-heptyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[1-(4-carbethoxyphenyl)-3-heptyl-5-keto-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoic acid ethyl ester Formula: C30H37N3O6S MolecularWeight: 567.69628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(C(=O)N(C1=S)C2=CC=C(C=C2)C(=O)OCC)CC(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCCCCCN1C(C(=O)N(C1=S)C2=CC=C(C=C2)C(=O)OCC)CC(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C30H37N3O6S/c1-4-7-8-9-10-19-32-25(20-26(34)31-23-15-11-21(12-16-23)28(36)38-5-2)27(35)33(30(32)40)24-17-13-22(14-18-24)29(37)39-6-3/h11-18,25H,4-10,19-20H2,1-3H3,(H,31,34)