2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid

Systemtic Name: 2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid Openeye Name: 2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid CAS Name: 2-[2-(4-ethoxyphenoxy)ethylthio]-3-(4-fluorophenyl)-4-imidazolecarboxylic acid IUPAC Name: 2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid Traditional Name: 2-[2-(4-ethoxyphenoxy)ethylthio]-3-(4-fluorophenyl)imidazole-4-carboxylic acid Formula: C20H19FN2O4S MolecularWeight: 402.439263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NC=C(N2C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NC=C(N2C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C20H19FN2O4S/c1-2-26-16-7-9-17(10-8-16)27-11-12-28-20-22-13-18(19(24)25)23(20)15-5-3-14(21)4-6-15/h3-10,13H,2,11-12H2,1H3,(H,24,25)