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

Systemtic Name: ethyl 4-[5-(hydroxymethyl)-1-(2-methylpropyl)imidazol-2-yl]sulfanylbutanoate Openeye Name: ethyl 4-[5-(hydroxymethyl)-1-isobutyl-imidazol-2-yl]sulfanylbutanoate CAS Name: 4-[[5-(hydroxymethyl)-1-(2-methylpropyl)-2-imidazolyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[5-(hydroxymethyl)-1-(2-methylpropyl)imidazol-2-yl]sulfanylbutanoate Traditional Name: 4-[(1-isobutyl-5-methylol-imidazol-2-yl)thio]butyric acid ethyl ester Formula: C14H24N2O3S MolecularWeight: 300.41696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC=C(N1CC(C)C)CO

Isomeric SMILES

CCOC(=O)CCCSC1=NC=C(N1CC(C)C)CO

InChI

InChI=1S/C14H24N2O3S/c1-4-19-13(18)6-5-7-20-14-15-8-12(10-17)16(14)9-11(2)3/h8,11,17H,4-7,9-10H2,1-3H3