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

Systemtic Name: 3-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-1,2,3-benzotriazin-4-one Formula: C16H10BrN5O2S MolecularWeight: 416.2519

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NN=C(O3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NN=C(O3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C16H10BrN5O2S/c17-11-5-3-4-10(8-11)14-19-20-16(24-14)25-9-22-15(23)12-6-1-2-7-13(12)18-21-22/h1-8H,9H2