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

Systemtic Name: 3-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(5-chloro-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(5-chloro-1,3-benzoxazol-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(5-chloro-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(5-chloro-1,3-benzoxazol-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C15H9ClN4O2S MolecularWeight: 344.77556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C15H9ClN4O2S/c16-9-5-6-13-12(7-9)17-15(22-13)23-8-20-14(21)10-3-1-2-4-11(10)18-19-20/h1-7H,8H2