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

Systemtic Name: methyl 4-[2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxycarbonylphenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxycarbonylphenyl)-5-oxo-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxycarbonylphenyl)-5-oxo-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxycarbonylphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[1-(4-carbethoxyphenyl)-3-homoveratryl-5-keto-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoic acid methyl ester Formula: C32H33N3O8S MolecularWeight: 619.68472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(N(C2=S)CCC3=CC(=C(C=C3)OC)OC)CC(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(N(C2=S)CCC3=CC(=C(C=C3)OC)OC)CC(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C32H33N3O8S/c1-5-43-31(39)22-9-13-24(14-10-22)35-29(37)25(19-28(36)33-23-11-7-21(8-12-23)30(38)42-4)34(32(35)44)17-16-20-6-15-26(40-2)27(18-20)41-3/h6-15,18,25H,5,16-17,19H2,1-4H3,(H,33,36)