methyl 5-[(3-fluorophenyl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[(3-fluorophenyl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[(3-fluorobenzoyl)amino]benzothiophene-2-carboxylate CAS Name: 5-[[(3-fluorophenyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[(3-fluorobenzoyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[(3-fluorobenzoyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C17H12FNO3S MolecularWeight: 329.345483

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C17H12FNO3S/c1-22-17(21)15-9-11-8-13(5-6-14(11)23-15)19-16(20)10-3-2-4-12(18)7-10/h2-9H,1H3,(H,19,20)