5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazole-2-thiolate

Systemtic Name: 5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazole-2-thiolate Openeye Name: 5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazole-2-thiolate CAS Name: 5-(1-benzotriazolylmethyl)-1,3,4-oxadiazole-2-thiolate IUPAC Name: 5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazole-2-thiolate Traditional Name: 5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazole-2-thiolate Formula: C9H6N5OS- MolecularWeight: 232.24184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC3=NN=C(O3)[S-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC3=NN=C(O3)[S-]

InChI

InChI=1S/C9H7N5OS/c16-9-12-11-8(15-9)5-14-7-4-2-1-3-6(7)10-13-14/h1-4H,5H2,(H,12,16)/p-1