3-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]methyl]-1,2,3-benzotriazin-4-one Formula: C14H8ClF3N4OS MolecularWeight: 372.75273

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C14H8ClF3N4OS/c15-10-5-8(14(16,17)18)6-19-12(10)24-7-22-13(23)9-3-1-2-4-11(9)20-21-22/h1-6H,7H2