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

Systemtic Name: methyl 4-[[[4-fluoranyl-3-(methoxymethyl)-1-benzothiophen-2-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[4-fluoro-3-(methoxymethyl)benzothiophene-2-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[[4-fluoro-3-(methoxymethyl)-1-benzothiophen-2-yl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[4-fluoro-3-(methoxymethyl)benzothiophene-2-carbonyl]amino]methyl]benzoic acid methyl ester Formula: C20H18FNO4S MolecularWeight: 387.424623

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H18FNO4S/c1-25-11-14-17-15(21)4-3-5-16(17)27-18(14)19(23)22-10-12-6-8-13(9-7-12)20(24)26-2/h3-9H,10-11H2,1-2H3,(H,22,23)