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

Systemtic Name: 2-[(4-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-3-methyl-pentanoic acid Openeye Name: 2-[(4-fluorobenzothiophene-2-carbonyl)amino]-3-methyl-pentanoic acid CAS Name: 2-[[(4-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[(4-fluoro-1-benzothiophene-2-carbonyl)amino]-3-methylpentanoic acid Traditional Name: 2-[(4-fluorobenzothiophene-2-carbonyl)amino]-3-methyl-valeric acid Formula: C15H16FNO3S MolecularWeight: 309.355843

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C1=CC2=C(C=CC=C2S1)F

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C1=CC2=C(C=CC=C2S1)F

InChI

InChI=1S/C15H16FNO3S/c1-3-8(2)13(15(19)20)17-14(18)12-7-9-10(16)5-4-6-11(9)21-12/h4-8,13H,3H2,1-2H3,(H,17,18)(H,19,20)