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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C31H33N3O5S/c1-3-20-39-26-16-12-24(13-17-26)32-28(35)21-27-29(36)34(25-14-10-23(11-15-25)30(37)38-4-2)31(40)33(27)19-18-22-8-6-5-7-9-22/h5-17,27H,3-4,18-21H2,1-2H3,(H,32,35)