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

Systemtic Name: 4-[(3-bromanyl-4-methoxy-phenyl)methyl]-3-[(4-chloranylphenoxy)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(3-bromo-4-methoxy-phenyl)methyl]-3-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(3-bromo-4-methoxyphenyl)methyl]-3-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(3-bromo-4-methoxyphenyl)methyl]-3-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-bromo-4-methoxy-benzyl)-3-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C17H15BrClN3O2S MolecularWeight: 440.7419

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=NNC2=S)COC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=NNC2=S)COC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C17H15BrClN3O2S/c1-23-15-7-2-11(8-14(15)18)9-22-16(20-21-17(22)25)10-24-13-5-3-12(19)4-6-13/h2-8H,9-10H2,1H3,(H,21,25)