5-(2-bromophenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(2-bromophenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione Openeye Name: 5-(2-bromophenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione CAS Name: 5-(2-bromophenyl)-3-(1-pyrrolidin-1-iumylmethyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(2-bromophenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione Traditional Name: 5-(2-bromophenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione Formula: C13H15BrN3OS+ MolecularWeight: 341.2467

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CN2C(=S)OC(=N2)C3=CC=CC=C3Br

Isomeric SMILES

C1CC[NH+](C1)CN2C(=S)OC(=N2)C3=CC=CC=C3Br

InChI

InChI=1S/C13H14BrN3OS/c14-11-6-2-1-5-10(11)12-15-17(13(19)18-12)9-16-7-3-4-8-16/h1-2,5-6H,3-4,7-9H2/p+1