2-[(5-bromanylnaphthalen-1-yl)carbothioyl-ethyl-amino]ethanoic acid

Systemtic Name: 2-[(5-bromanylnaphthalen-1-yl)carbothioyl-ethyl-amino]ethanoic acid Openeye Name: 2-[(5-bromonaphthalene-1-carbothioyl)-ethyl-amino]acetic acid CAS Name: 2-[[(5-bromo-1-naphthalenyl)-sulfanylidenemethyl]-ethylamino]acetic acid IUPAC Name: 2-[(5-bromonaphthalene-1-carbothioyl)-ethylamino]acetic acid Traditional Name: 2-[(5-bromonaphthalene-1-carbothioyl)-ethyl-amino]acetic acid Formula: C15H14BrNO2S MolecularWeight: 352.24616

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)O)C(=S)C1=CC=CC2=C1C=CC=C2Br

Isomeric SMILES

CCN(CC(=O)O)C(=S)C1=CC=CC2=C1C=CC=C2Br

InChI

InChI=1S/C15H14BrNO2S/c1-2-17(9-14(18)19)15(20)12-7-3-6-11-10(12)5-4-8-13(11)16/h3-8H,2,9H2,1H3,(H,18,19)