5-[(6-bromanylnaphthalen-2-yl)oxymethyl]-4-[(2S)-butan-2-yl]-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(6-bromanylnaphthalen-2-yl)oxymethyl]-4-[(2S)-butan-2-yl]-1,2,4-triazole-3-thiolate Openeye Name: 5-[(6-bromo-2-naphthyl)oxymethyl]-4-[(1S)-1-methylpropyl]-1,2,4-triazole-3-thiolate CAS Name: 5-[(6-bromo-2-naphthalenyl)oxymethyl]-4-[(2S)-butan-2-yl]-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(6-bromonaphthalen-2-yl)oxymethyl]-4-[(2S)-butan-2-yl]-1,2,4-triazole-3-thiolate Traditional Name: 5-[(6-bromo-2-naphthoxy)methyl]-4-[(1S)-1-methylpropyl]-1,2,4-triazole-3-thiolate Formula: C17H17BrN3OS- MolecularWeight: 391.30538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NN=C1[S-])COC2=CC3=C(C=C2)C=C(C=C3)Br

Isomeric SMILES

CC[C@H](C)N1C(=NN=C1[S-])COC2=CC3=C(C=C2)C=C(C=C3)Br

InChI

InChI=1S/C17H18BrN3OS/c1-3-11(2)21-16(19-20-17(21)23)10-22-15-7-5-12-8-14(18)6-4-13(12)9-15/h4-9,11H,3,10H2,1-2H3,(H,20,23)/p-1/t11-/m0/s1