[2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]acetic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]acetic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C17H20FN3O3S MolecularWeight: 365.422403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC(=O)CSC1=NC=CN1C2=CC(=CC=C2)F

Isomeric SMILES

CC(C)(C)NC(=O)COC(=O)CSC1=NC=CN1C2=CC(=CC=C2)F

InChI

InChI=1S/C17H20FN3O3S/c1-17(2,3)20-14(22)10-24-15(23)11-25-16-19-7-8-21(16)13-6-4-5-12(18)9-13/h4-9H,10-11H2,1-3H3,(H,20,22)