2-[4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-bromanyl-6-ethoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-bromanyl-6-ethoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]-2-bromo-6-ethoxy-phenoxy]acetic acid CAS Name: 2-[4-[(2-amino-4-oxo-5-thiazolylidene)methyl]-2-bromo-6-ethoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-bromo-6-ethoxyphenoxy]acetic acid Traditional Name: 2-[4-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-2-bromo-6-ethoxy-phenoxy]acetic acid Formula: C14H13BrN2O5S MolecularWeight: 401.23242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)N)Br)OCC(=O)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)N)Br)OCC(=O)O

InChI

InChI=1S/C14H13BrN2O5S/c1-2-21-9-4-7(5-10-13(20)17-14(16)23-10)3-8(15)12(9)22-6-11(18)19/h3-5H,2,6H2,1H3,(H,18,19)(H2,16,17,20)