3-[(5-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[(5-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-4-methyl-benzoic acid Openeye Name: 3-[(5-fluorobenzothiophene-2-carbonyl)amino]-4-methyl-benzoic acid CAS Name: 3-[[(5-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[(5-fluoro-1-benzothiophene-2-carbonyl)amino]-4-methylbenzoic acid Traditional Name: 3-[(5-fluorobenzothiophene-2-carbonyl)amino]-4-methyl-benzoic acid Formula: C17H12FNO3S MolecularWeight: 329.345483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC3=C(S2)C=CC(=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC3=C(S2)C=CC(=C3)F

InChI

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