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

Systemtic Name: 3-[5-[(4-bromophenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]pyridine Openeye Name: 3-[5-[(4-bromophenyl)methylsulfanyl]tetrazol-1-yl]pyridine CAS Name: 3-[5-[(4-bromophenyl)methylthio]-1-tetrazolyl]pyridine IUPAC Name: 3-[5-[(4-bromophenyl)methylsulfanyl]tetrazol-1-yl]pyridine Traditional Name: 3-[5-[(4-bromobenzyl)thio]tetrazol-1-yl]pyridine Formula: C13H10BrN5S MolecularWeight: 348.221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)N2C(=NN=N2)SCC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CN=C1)N2C(=NN=N2)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C13H10BrN5S/c14-11-5-3-10(4-6-11)9-20-13-16-17-18-19(13)12-2-1-7-15-8-12/h1-8H,9H2