5-(4-bromophenyl)-4-(3-chloranyl-4-methoxy-phenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-bromophenyl)-4-(3-chloranyl-4-methoxy-phenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-bromophenyl)-4-(3-chloro-4-methoxy-phenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(4-bromophenyl)-4-(3-chloro-4-methoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-bromophenyl)-4-(3-chloro-4-methoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-bromophenyl)-4-(3-chloro-4-methoxy-phenyl)-1,2,4-triazole-3-thiolate Formula: C15H10BrClN3OS- MolecularWeight: 395.6814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=NN=C2[S-])C3=CC=C(C=C3)Br)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=NN=C2[S-])C3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C15H11BrClN3OS/c1-21-13-7-6-11(8-12(13)17)20-14(18-19-15(20)22)9-2-4-10(16)5-3-9/h2-8H,1H3,(H,19,22)/p-1