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

Systemtic Name: 3-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[[5-(4-bromophenyl)-1H-imidazol-2-yl]thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[[5-(4-bromophenyl)-1H-imidazol-2-yl]thio]methyl]-1,2,3-benzotriazin-4-one Formula: C17H12BrN5OS MolecularWeight: 414.27908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NC=C(N3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NC=C(N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C17H12BrN5OS/c18-12-7-5-11(6-8-12)15-9-19-17(20-15)25-10-23-16(24)13-3-1-2-4-14(13)21-22-23/h1-9H,10H2,(H,19,20)