ethyl 4-[1-[(3-fluorophenyl)methyl]-5-(hydroxymethyl)imidazol-2-yl]sulfanylbutanoate

Systemtic Name: ethyl 4-[1-[(3-fluorophenyl)methyl]-5-(hydroxymethyl)imidazol-2-yl]sulfanylbutanoate Openeye Name: ethyl 4-[1-[(3-fluorophenyl)methyl]-5-(hydroxymethyl)imidazol-2-yl]sulfanylbutanoate CAS Name: 4-[[1-[(3-fluorophenyl)methyl]-5-(hydroxymethyl)-2-imidazolyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[1-[(3-fluorophenyl)methyl]-5-(hydroxymethyl)imidazol-2-yl]sulfanylbutanoate Traditional Name: 4-[[1-(3-fluorobenzyl)-5-methylol-imidazol-2-yl]thio]butyric acid ethyl ester Formula: C17H21FN2O3S MolecularWeight: 352.423643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC=C(N1CC2=CC(=CC=C2)F)CO

Isomeric SMILES

CCOC(=O)CCCSC1=NC=C(N1CC2=CC(=CC=C2)F)CO

InChI

InChI=1S/C17H21FN2O3S/c1-2-23-16(22)7-4-8-24-17-19-10-15(12-21)20(17)11-13-5-3-6-14(18)9-13/h3,5-6,9-10,21H,2,4,7-8,11-12H2,1H3