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

Systemtic Name: ethyl 4-[2-[3-[2-(4-methoxyphenyl)ethyl]-5-oxidanylidene-1-phenethyl-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[3-[2-(4-methoxyphenyl)ethyl]-5-oxo-1-phenethyl-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[3-[2-(4-methoxyphenyl)ethyl]-5-oxo-1-phenethyl-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-[2-(4-methoxyphenyl)ethyl]-5-oxo-1-phenethyl-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[5-keto-3-[2-(4-methoxyphenyl)ethyl]-1-phenethyl-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoic acid ethyl ester Formula: C31H33N3O5S MolecularWeight: 559.67582

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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=C(C=C3)OC)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=C(C=C3)OC)CCC4=CC=CC=C4

InChI

InChI=1S/C31H33N3O5S/c1-3-39-30(37)24-11-13-25(14-12-24)32-28(35)21-27-29(36)34(20-18-22-7-5-4-6-8-22)31(40)33(27)19-17-23-9-15-26(38-2)16-10-23/h4-16,27H,3,17-21H2,1-2H3,(H,32,35)