4-(2-bromanyl-4-methyl-phenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(2-bromanyl-4-methyl-phenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(2-bromo-4-methyl-phenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(2-bromo-4-methylphenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(2-bromo-4-methylphenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(2-bromo-4-methyl-phenyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C16H13BrN3OS- MolecularWeight: 375.26292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN=C2[S-])C3=CC=C(C=C3)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN=C2[S-])C3=CC=C(C=C3)OC)Br

InChI

InChI=1S/C16H14BrN3OS/c1-10-3-8-14(13(17)9-10)20-15(18-19-16(20)22)11-4-6-12(21-2)7-5-11/h3-9H,1-2H3,(H,19,22)/p-1