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

Systemtic Name: ethyl 2-[4-bromanyl-2-[(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-bromo-2-[(5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]acetate CAS Name: 2-[4-bromo-2-[(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-bromo-2-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetate Traditional Name: 2-[4-bromo-2-[(5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]acetic acid ethyl ester Formula: C14H13BrN2O4S MolecularWeight: 385.23302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)Br)C=C2C(=O)NC(=S)N2

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)Br)C=C2C(=O)NC(=S)N2

InChI

InChI=1S/C14H13BrN2O4S/c1-2-20-12(18)7-21-11-4-3-9(15)5-8(11)6-10-13(19)17-14(22)16-10/h3-6H,2,7H2,1H3,(H2,16,17,19,22)