3-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[2-(5-bromo-2-thienyl)-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[2-(5-bromo-2-thiophenyl)-2-oxoethyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[2-(5-bromothiophen-2-yl)-2-oxoethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[2-(5-bromo-2-thienyl)-2-keto-ethyl]-1,2,3-benzotriazin-4-one Formula: C13H8BrN3O2S MolecularWeight: 350.19052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CC(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CC(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C13H8BrN3O2S/c14-12-6-5-11(20-12)10(18)7-17-13(19)8-3-1-2-4-9(8)15-16-17/h1-6H,7H2