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

Systemtic Name: 2-[(5-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(5-fluorobenzothiophene-2-carbonyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[(5-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(5-fluoro-1-benzothiophene-2-carbonyl)amino]-3-methylbutanoic acid Traditional Name: 2-[(5-fluorobenzothiophene-2-carbonyl)amino]-3-methyl-butyric acid Formula: C14H14FNO3S MolecularWeight: 295.329263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14FNO3S/c1-7(2)12(14(18)19)16-13(17)11-6-8-5-9(15)3-4-10(8)20-11/h3-7,12H,1-2H3,(H,16,17)(H,18,19)