butyl 4-[[4-fluoranyl-3-(methoxymethyl)-1-benzothiophen-2-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[4-fluoranyl-3-(methoxymethyl)-1-benzothiophen-2-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[4-fluoro-3-(methoxymethyl)benzothiophene-2-carbonyl]amino]benzoate CAS Name: 4-[[[4-fluoro-3-(methoxymethyl)-1-benzothiophen-2-yl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carbonyl]amino]benzoate Traditional Name: 4-[[4-fluoro-3-(methoxymethyl)benzothiophene-2-carbonyl]amino]benzoic acid butyl ester Formula: C22H22FNO4S MolecularWeight: 415.477783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(C=CC=C3S2)F)COC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(C=CC=C3S2)F)COC

InChI

InChI=1S/C22H22FNO4S/c1-3-4-12-28-22(26)14-8-10-15(11-9-14)24-21(25)20-16(13-27-2)19-17(23)6-5-7-18(19)29-20/h5-11H,3-4,12-13H2,1-2H3,(H,24,25)