2-[5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 2-[5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 2-[5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine CAS Name: 2-[5-[(4-bromophenyl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 2-[5-[(4-bromophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 2-[5-[(4-bromobenzyl)thio]-4-phenyl-1,2,4-triazol-3-yl]pyridine Formula: C20H15BrN4S MolecularWeight: 423.3289

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Br)C4=CC=CC=N4

InChI

InChI=1S/C20H15BrN4S/c21-16-11-9-15(10-12-16)14-26-20-24-23-19(18-8-4-5-13-22-18)25(20)17-6-2-1-3-7-17/h1-13H,14H2