3-[(6-bromanylnaphthalen-2-yl)oxymethyl]-4-(2,3-dimethylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(6-bromanylnaphthalen-2-yl)oxymethyl]-4-(2,3-dimethylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(6-bromo-2-naphthyl)oxymethyl]-4-(2,3-dimethylphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(6-bromo-2-naphthalenyl)oxymethyl]-4-(2,3-dimethylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(6-bromonaphthalen-2-yl)oxymethyl]-4-(2,3-dimethylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(6-bromo-2-naphthoxy)methyl]-4-(2,3-dimethylphenyl)-1H-1,2,4-triazole-5-thione Formula: C21H18BrN3OS MolecularWeight: 440.35612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=NNC2=S)COC3=CC4=C(C=C3)C=C(C=C4)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=NNC2=S)COC3=CC4=C(C=C3)C=C(C=C4)Br)C

InChI

InChI=1S/C21H18BrN3OS/c1-13-4-3-5-19(14(13)2)25-20(23-24-21(25)27)12-26-18-9-7-15-10-17(22)8-6-16(15)11-18/h3-11H,12H2,1-2H3,(H,24,27)