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

Systemtic Name: 3-[(4-bromophenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(4-bromophenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(4-bromophenyl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(4-bromophenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(4-bromophenyl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C14H10BrN3OS MolecularWeight: 348.2177

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C14H10BrN3OS/c15-10-5-7-11(8-6-10)20-9-18-14(19)12-3-1-2-4-13(12)16-17-18/h1-8H,9H2