4-[[2-chloranyl-4-[(Z)-(1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]methyl]benzoate

Systemtic Name: 4-[[2-chloranyl-4-[(Z)-(1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]methyl]benzoate Openeye Name: 4-[[2-chloro-4-[(Z)-(1-ethyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-chloro-4-[(Z)-(1-ethyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]phenoxy]methyl]benzoate IUPAC Name: 4-[[2-chloro-4-[(Z)-(1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]methyl]benzoate Traditional Name: 4-[[2-chloro-4-[(Z)-(1-ethyl-5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]methyl]benzoate Formula: C20H16ClN2O4S- MolecularWeight: 415.87004

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)[O-])Cl)NC1=S

Isomeric SMILES

CCN1C(=O)/C(=C/C2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)[O-])Cl)/NC1=S

InChI

InChI=1S/C20H17ClN2O4S/c1-2-23-18(24)16(22-20(23)28)10-13-5-8-17(15(21)9-13)27-11-12-3-6-14(7-4-12)19(25)26/h3-10H,2,11H2,1H3,(H,22,28)(H,25,26)/p-1/b16-10-