ethyl 4-[5-(hydroxymethyl)-1-(oxolan-2-ylmethyl)imidazol-2-yl]sulfanylbutanoate

Systemtic Name: ethyl 4-[5-(hydroxymethyl)-1-(oxolan-2-ylmethyl)imidazol-2-yl]sulfanylbutanoate Openeye Name: ethyl 4-[5-(hydroxymethyl)-1-(tetrahydrofuran-2-ylmethyl)imidazol-2-yl]sulfanylbutanoate CAS Name: 4-[[5-(hydroxymethyl)-1-(2-oxolanylmethyl)-2-imidazolyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[5-(hydroxymethyl)-1-(oxolan-2-ylmethyl)imidazol-2-yl]sulfanylbutanoate Traditional Name: 4-[[5-methylol-1-(tetrahydrofurfuryl)imidazol-2-yl]thio]butyric acid ethyl ester Formula: C15H24N2O4S MolecularWeight: 328.42706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC=C(N1CC2CCCO2)CO

Isomeric SMILES

CCOC(=O)CCCSC1=NC=C(N1CC2CCCO2)CO

InChI

InChI=1S/C15H24N2O4S/c1-2-20-14(19)6-4-8-22-15-16-9-12(11-18)17(15)10-13-5-3-7-21-13/h9,13,18H,2-8,10-11H2,1H3