5-(2-bromophenyl)-3-[(2-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(2-bromophenyl)-3-[(2-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-bromophenyl)-3-[(2-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-bromophenyl)-3-[(2-nitrophenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-bromophenyl)-3-[(2-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-bromophenyl)-3-[(2-nitrobenzyl)thio]-1H-1,2,4-triazole Formula: C15H11BrN4O2S MolecularWeight: 391.24244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NNC(=N2)C3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NNC(=N2)C3=CC=CC=C3Br)[N+](=O)[O-]

InChI

InChI=1S/C15H11BrN4O2S/c16-12-7-3-2-6-11(12)14-17-15(19-18-14)23-9-10-5-1-4-8-13(10)20(21)22/h1-8H,9H2,(H,17,18,19)