2-[2-ethoxy-6-iodanyl-4-[(E)-(3-methyl-5-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-ethoxy-6-iodanyl-4-[(E)-(3-methyl-5-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-(1-allyl-3-methyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]-2-ethoxy-6-iodo-phenoxy]acetic acid CAS Name: 2-[2-ethoxy-6-iodo-4-[(E)-(3-methyl-5-oxo-1-prop-2-enyl-2-sulfanylidene-4-imidazolidinylidene)methyl]phenoxy]acetic acid IUPAC Name: 2-[2-ethoxy-6-iodo-4-[(E)-(3-methyl-5-oxo-1-prop-2-enyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetic acid Traditional Name: 2-[4-[(E)-(1-allyl-5-keto-3-methyl-2-thioxo-imidazolidin-4-ylidene)methyl]-2-ethoxy-6-iodo-phenoxy]acetic acid Formula: C18H19IN2O5S MolecularWeight: 502.32333

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)N2C)CC=C)I)OCC(=O)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)N(C(=S)N2C)CC=C)I)OCC(=O)O

InChI

InChI=1S/C18H19IN2O5S/c1-4-6-21-17(24)13(20(3)18(21)27)8-11-7-12(19)16(26-10-15(22)23)14(9-11)25-5-2/h4,7-9H,1,5-6,10H2,2-3H3,(H,22,23)/b13-8+