2-[(5-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(5-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(5-fluorobenzothiophene-2-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(5-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(5-fluoro-1-benzothiophene-2-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(5-fluorobenzothiophene-2-carbonyl)amino]-4-(methylthio)butyric acid Formula: C14H14FNO3S2 MolecularWeight: 327.394263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14FNO3S2/c1-20-5-4-10(14(18)19)16-13(17)12-7-8-6-9(15)2-3-11(8)21-12/h2-3,6-7,10H,4-5H2,1H3,(H,16,17)(H,18,19)