2-[[5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[[5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[[5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-phenyl-ethanone CAS Name: 2-[[5-(1-benzotriazolylmethyl)-1,3,4-oxadiazol-2-yl]thio]-1-phenylethanone IUPAC Name: 2-[[5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-phenylethanone Traditional Name: 2-[[5-(benzotriazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]thio]-1-phenyl-ethanone Formula: C17H13N5O2S MolecularWeight: 351.38242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H13N5O2S/c23-15(12-6-2-1-3-7-12)11-25-17-20-19-16(24-17)10-22-14-9-5-4-8-13(14)18-21-22/h1-9H,10-11H2