3-[(4-bromophenyl)methylsulfanyl]-4-phenyl-5-(phenylsulfanylmethyl)-1,2,4-triazole

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-4-phenyl-5-(phenylsulfanylmethyl)-1,2,4-triazole Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-4-phenyl-5-(phenylsulfanylmethyl)-1,2,4-triazole CAS Name: 3-[(4-bromophenyl)methylthio]-4-phenyl-5-[(phenylthio)methyl]-1,2,4-triazole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-4-phenyl-5-(phenylsulfanylmethyl)-1,2,4-triazole Traditional Name: 3-[(4-bromobenzyl)thio]-4-phenyl-5-[(phenylthio)methyl]-1,2,4-triazole Formula: C22H18BrN3S2 MolecularWeight: 468.43242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)CSC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)CSC4=CC=CC=C4

InChI

InChI=1S/C22H18BrN3S2/c23-18-13-11-17(12-14-18)15-28-22-25-24-21(16-27-20-9-5-2-6-10-20)26(22)19-7-3-1-4-8-19/h1-14H,15-16H2