2-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[1-(4-bromophenyl)-5-tetrazolyl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[1-(4-bromophenyl)tetrazol-5-yl]thio]-1-pyrrolidino-ethanone Formula: C13H14BrN5OS MolecularWeight: 368.25216

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NN=NN2C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NN=NN2C3=CC=C(C=C3)Br

InChI

InChI=1S/C13H14BrN5OS/c14-10-3-5-11(6-4-10)19-13(15-16-17-19)21-9-12(20)18-7-1-2-8-18/h3-6H,1-2,7-9H2