3-[(3-bromanyl-4-methoxy-phenyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(3-bromanyl-4-methoxy-phenyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(3-bromo-4-methoxy-phenyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3-bromo-4-methoxyphenyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3-bromo-4-methoxyphenyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(3-bromo-4-methoxy-benzyl)-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C16H14BrN3OS MolecularWeight: 376.27086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NNC(=S)N2C3=CC=CC=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NNC(=S)N2C3=CC=CC=C3)Br

InChI

InChI=1S/C16H14BrN3OS/c1-21-14-8-7-11(9-13(14)17)10-15-18-19-16(22)20(15)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,22)