N-[(4-fluorophenyl)methyl]-2-[5-(hydroxymethyl)-2-phenethylsulfanyl-imidazol-1-yl]ethanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-[5-(hydroxymethyl)-2-phenethylsulfanyl-imidazol-1-yl]ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[5-(hydroxymethyl)-2-phenethylsulfanyl-imidazol-1-yl]acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[5-(hydroxymethyl)-2-(phenethylthio)-1-imidazolyl]acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-[5-(hydroxymethyl)-2-phenethylsulfanylimidazol-1-yl]acetamide Traditional Name: N-(4-fluorobenzyl)-2-[5-methylol-2-(phenethylthio)imidazol-1-yl]acetamide Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NC=C(N2CC(=O)NCC3=CC=C(C=C3)F)CO

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NC=C(N2CC(=O)NCC3=CC=C(C=C3)F)CO

InChI

InChI=1S/C21H22FN3O2S/c22-18-8-6-17(7-9-18)12-23-20(27)14-25-19(15-26)13-24-21(25)28-11-10-16-4-2-1-3-5-16/h1-9,13,26H,10-12,14-15H2,(H,23,27)