methyl 6-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]amino]hexanoate CAS Name: 6-[[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]amino]hexanoate Traditional Name: 6-[[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]amino]hexanoic acid methyl ester Formula: C18H22FN3O3S MolecularWeight: 379.448983

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=CN=C(N1C2=CC=C(C=C2)F)SC

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=CN=C(N1C2=CC=C(C=C2)F)SC

InChI

InChI=1S/C18H22FN3O3S/c1-25-16(23)6-4-3-5-11-20-17(24)15-12-21-18(26-2)22(15)14-9-7-13(19)8-10-14/h7-10,12H,3-6,11H2,1-2H3,(H,20,24)