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

Systemtic Name: 2-[(5-bromanylnaphthalen-1-yl)carbothioyl-propyl-amino]ethanoic acid Openeye Name: 2-[(5-bromonaphthalene-1-carbothioyl)-propyl-amino]acetic acid CAS Name: 2-[[(5-bromo-1-naphthalenyl)-sulfanylidenemethyl]-propylamino]acetic acid IUPAC Name: 2-[(5-bromonaphthalene-1-carbothioyl)-propylamino]acetic acid Traditional Name: 2-[(5-bromonaphthalene-1-carbothioyl)-propyl-amino]acetic acid Formula: C16H16BrNO2S MolecularWeight: 366.27274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrNO2S/c1-2-9-18(10-15(19)20)16(21)13-7-3-6-12-11(13)5-4-8-14(12)17/h3-8H,2,9-10H2,1H3,(H,19,20)