2-[4-bromanyl-2-[(Z)-(5-oxidanylidene-1-propyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]ethanoate

Systemtic Name: 2-[4-bromanyl-2-[(Z)-(5-oxidanylidene-1-propyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]ethanoate Openeye Name: 2-[4-bromo-2-[(Z)-(5-oxo-1-propyl-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]acetate CAS Name: 2-[4-bromo-2-[(Z)-(5-oxo-1-propyl-2-sulfanylidene-4-imidazolidinylidene)methyl]phenoxy]acetate IUPAC Name: 2-[4-bromo-2-[(Z)-(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetate Traditional Name: 2-[4-bromo-2-[(Z)-(5-keto-1-propyl-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]acetate Formula: C15H14BrN2O4S- MolecularWeight: 398.25166

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CC2=C(C=CC(=C2)Br)OCC(=O)[O-])NC1=S

Isomeric SMILES

CCCN1C(=O)/C(=C/C2=C(C=CC(=C2)Br)OCC(=O)[O-])/NC1=S

InChI

InChI=1S/C15H15BrN2O4S/c1-2-5-18-14(21)11(17-15(18)23)7-9-6-10(16)3-4-12(9)22-8-13(19)20/h3-4,6-7H,2,5,8H2,1H3,(H,17,23)(H,19,20)/p-1/b11-7-