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

Systemtic Name: 2-[[2-(4-bromophenyl)quinolin-4-yl]carbothioyl-methyl-amino]ethanoic acid Openeye Name: 2-[[2-(4-bromophenyl)quinoline-4-carbothioyl]-methyl-amino]acetic acid CAS Name: 2-[[[2-(4-bromophenyl)-4-quinolinyl]-sulfanylidenemethyl]-methylamino]acetic acid IUPAC Name: 2-[[2-(4-bromophenyl)quinoline-4-carbothioyl]-methylamino]acetic acid Traditional Name: 2-[[2-(4-bromophenyl)quinoline-4-carbothioyl]-methyl-amino]acetic acid Formula: C19H15BrN2O2S MolecularWeight: 415.3036

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=S)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(CC(=O)O)C(=S)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H15BrN2O2S/c1-22(11-18(23)24)19(25)15-10-17(12-6-8-13(20)9-7-12)21-16-5-3-2-4-14(15)16/h2-10H,11H2,1H3,(H,23,24)