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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC(C(C)C)C(=O)O

InChI

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