3-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(5-benzyl-1,3,4-oxadiazol-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C17H13N5O2S MolecularWeight: 351.38242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(O2)SCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(O2)SCN3C(=O)C4=CC=CC=C4N=N3

InChI

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