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2-[methyl-[8-(trifluoromethyl)quinolin-4-yl]carbothioyl-amino]ethanoic acid

2-[methyl-[8-(trifluoromethyl)quinolin-4-yl]carbothioyl-amino]ethanoic acid

Systemtic Name:2-[methyl-[8-(trifluoromethyl)quinolin-4-yl]carbothioyl-amino]ethanoic acid
Openeye Name:2-[methyl-[8-(trifluoromethyl)quinoline-4-carbothioyl]amino]acetic acid
CAS Name:2-[methyl-[sulfanylidene-[8-(trifluoromethyl)-4-quinolinyl]methyl]amino]acetic acid
IUPAC Name:2-[methyl-[8-(trifluoromethyl)quinoline-4-carbothioyl]amino]acetic acid
Traditional Name:2-[methyl-[8-(trifluoromethyl)quinoline-4-carbothioyl]amino]acetic acid
Formula: C14H11F3N2O2S
MolecularWeight: 328.30955
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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=S)C1=C2C=CC=C(C2=NC=C1)C(F)(F)F


Isomeric SMILES

CN(CC(=O)O)C(=S)C1=C2C=CC=C(C2=NC=C1)C(F)(F)F


InChI

InChI=1S/C14H11F3N2O2S/c1-19(7-11(20)21)13(22)9-5-6-18-12-8(9)3-2-4-10(12)14(15,16)17/h2-6H,7H2,1H3,(H,20,21)


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