methyl 3-ethoxy-5-[2-(4-fluorophenyl)ethanoylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-ethoxy-5-[2-(4-fluorophenyl)ethanoylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-ethoxy-5-[[2-(4-fluorophenyl)acetyl]amino]benzothiophene-2-carboxylate CAS Name: 3-ethoxy-5-[[2-(4-fluorophenyl)-1-oxoethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-ethoxy-5-[[2-(4-fluorophenyl)acetyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-ethoxy-5-[[2-(4-fluorophenyl)acetyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C20H18FNO4S MolecularWeight: 387.424623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(SC2=C1C=C(C=C2)NC(=O)CC3=CC=C(C=C3)F)C(=O)OC

Isomeric SMILES

CCOC1=C(SC2=C1C=C(C=C2)NC(=O)CC3=CC=C(C=C3)F)C(=O)OC

InChI

InChI=1S/C20H18FNO4S/c1-3-26-18-15-11-14(8-9-16(15)27-19(18)20(24)25-2)22-17(23)10-12-4-6-13(21)7-5-12/h4-9,11H,3,10H2,1-2H3,(H,22,23)