methyl 6-[[4-fluoranyl-3-(phenoxymethyl)-1-benzothiophen-2-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[4-fluoranyl-3-(phenoxymethyl)-1-benzothiophen-2-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[[4-fluoro-3-(phenoxymethyl)benzothiophene-2-carbonyl]amino]hexanoate CAS Name: 6-[[[4-fluoro-3-(phenoxymethyl)-1-benzothiophen-2-yl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carbonyl]amino]hexanoate Traditional Name: 6-[[4-fluoro-3-(phenoxymethyl)benzothiophene-2-carbonyl]amino]hexanoic acid methyl ester Formula: C23H24FNO4S MolecularWeight: 429.504363

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=C(C2=C(C=CC=C2S1)F)COC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=C(C2=C(C=CC=C2S1)F)COC3=CC=CC=C3

InChI

InChI=1S/C23H24FNO4S/c1-28-20(26)13-6-3-7-14-25-23(27)22-17(15-29-16-9-4-2-5-10-16)21-18(24)11-8-12-19(21)30-22/h2,4-5,8-12H,3,6-7,13-15H2,1H3,(H,25,27)