tert-butyl 2-(1-phenylimidazol-2-yl)sulfanylethanoate

Systemtic Name: tert-butyl 2-(1-phenylimidazol-2-yl)sulfanylethanoate Openeye Name: tert-butyl 2-(1-phenylimidazol-2-yl)sulfanylacetate CAS Name: 2-[(1-phenyl-2-imidazolyl)thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(1-phenylimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-phenylimidazol-2-yl)thio]acetic acid tert-butyl ester Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NC=CN1C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NC=CN1C2=CC=CC=C2

InChI

InChI=1S/C15H18N2O2S/c1-15(2,3)19-13(18)11-20-14-16-9-10-17(14)12-7-5-4-6-8-12/h4-10H,11H2,1-3H3