(E)-5-(1-ethylimidazol-2-yl)sulfanyl-4-oxidanyl-nonadec-6-enoic acid

Systemtic Name: (E)-5-(1-ethylimidazol-2-yl)sulfanyl-4-oxidanyl-nonadec-6-enoic acid Openeye Name: (E)-5-(1-ethylimidazol-2-yl)sulfanyl-4-hydroxy-nonadec-6-enoic acid CAS Name: (E)-5-[(1-ethyl-2-imidazolyl)thio]-4-hydroxy-6-nonadecenoic acid IUPAC Name: (E)-5-(1-ethylimidazol-2-yl)sulfanyl-4-hydroxynonadec-6-enoic acid Traditional Name: (E)-5-[(1-ethylimidazol-2-yl)thio]-4-hydroxy-nonadec-6-enoic acid Formula: C24H42N2O3S MolecularWeight: 438.66688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC=CC(C(CCC(=O)O)O)SC1=NC=CN1CC

Isomeric SMILES

CCCCCCCCCCCC/C=C/C(C(CCC(=O)O)O)SC1=NC=CN1CC

InChI

InChI=1S/C24H42N2O3S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-22(21(27)17-18-23(28)29)30-24-25-19-20-26(24)4-2/h15-16,19-22,27H,3-14,17-18H2,1-2H3,(H,28,29)/b16-15+