[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]acetic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]acetic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C18H22FN3O3S MolecularWeight: 379.448983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22FN3O3S/c1-3-14(4-2)21-16(23)11-25-17(24)12-26-18-20-8-9-22(18)15-7-5-6-13(19)10-15/h5-10,14H,3-4,11-12H2,1-2H3,(H,21,23)