3-[(6-chloranyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(6-chloranyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C14H9ClN6OS MolecularWeight: 344.77886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NC4=NC=C(C=C4N3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NC4=NC=C(C=C4N3)Cl

InChI

InChI=1S/C14H9ClN6OS/c15-8-5-11-12(16-6-8)18-14(17-11)23-7-21-13(22)9-3-1-2-4-10(9)19-20-21/h1-6H,7H2,(H,16,17,18)