ethyl 4-[(4S)-3-cyclopropyl-4-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]benzoate

Systemtic Name: ethyl 4-[(4S)-3-cyclopropyl-4-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]benzoate Openeye Name: ethyl 4-[(4S)-3-cyclopropyl-4-[2-(4-ethoxyanilino)-2-oxo-ethyl]-5-oxo-2-thioxo-imidazolidin-1-yl]benzoate CAS Name: 4-[(4S)-3-cyclopropyl-4-[2-(4-ethoxyanilino)-2-oxoethyl]-5-oxo-2-sulfanylidene-1-imidazolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4S)-3-cyclopropyl-4-[2-(4-ethoxyanilino)-2-oxoethyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl]benzoate Traditional Name: 4-[(4S)-3-cyclopropyl-5-keto-4-[2-keto-2-(p-phenetidino)ethyl]-2-thioxo-imidazolidin-1-yl]benzoic acid ethyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2C3CC3)C4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C[C@H]2C(=O)N(C(=S)N2C3CC3)C4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C25H27N3O5S/c1-3-32-20-13-7-17(8-14-20)26-22(29)15-21-23(30)28(25(34)27(21)18-11-12-18)19-9-5-16(6-10-19)24(31)33-4-2/h5-10,13-14,18,21H,3-4,11-12,15H2,1-2H3,(H,26,29)/t21-/m0/s1