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

Systemtic Name: 2-[(5-bromanylnaphthalen-1-yl)carbothioyl-(phenylmethyl)amino]ethanoic acid Openeye Name: 2-[benzyl-(5-bromonaphthalene-1-carbothioyl)amino]acetic acid CAS Name: 2-[[(5-bromo-1-naphthalenyl)-sulfanylidenemethyl]-(phenylmethyl)amino]acetic acid IUPAC Name: 2-[benzyl-(5-bromonaphthalene-1-carbothioyl)amino]acetic acid Traditional Name: 2-[benzyl-(5-bromonaphthalene-1-carbothioyl)amino]acetic acid Formula: C20H16BrNO2S MolecularWeight: 414.31554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC(=O)O)C(=S)C2=CC=CC3=C2C=CC=C3Br

Isomeric SMILES

C1=CC=C(C=C1)CN(CC(=O)O)C(=S)C2=CC=CC3=C2C=CC=C3Br

InChI

InChI=1S/C20H16BrNO2S/c21-18-11-5-8-15-16(18)9-4-10-17(15)20(25)22(13-19(23)24)12-14-6-2-1-3-7-14/h1-11H,12-13H2,(H,23,24)