1-(5-bromanylthiophen-2-yl)-2-[(5,6-dipyridin-2-yl-1,2,4-triazin-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-2-[(5,6-dipyridin-2-yl-1,2,4-triazin-3-yl)sulfanyl]ethanone Openeye Name: 2-[[5,6-bis(2-pyridyl)-1,2,4-triazin-3-yl]sulfanyl]-1-(5-bromo-2-thienyl)ethanone CAS Name: 2-[[5,6-bis(2-pyridinyl)-1,2,4-triazin-3-yl]thio]-1-(5-bromo-2-thiophenyl)ethanone IUPAC Name: 1-(5-bromothiophen-2-yl)-2-[(5,6-dipyridin-2-yl-1,2,4-triazin-3-yl)sulfanyl]ethanone Traditional Name: 2-[[5,6-bis(2-pyridyl)-1,2,4-triazin-3-yl]thio]-1-(5-bromo-2-thienyl)ethanone Formula: C19H12BrN5OS2 MolecularWeight: 470.36548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=C(N=NC(=N2)SCC(=O)C3=CC=C(S3)Br)C4=CC=CC=N4

Isomeric SMILES

C1=CC=NC(=C1)C2=C(N=NC(=N2)SCC(=O)C3=CC=C(S3)Br)C4=CC=CC=N4

InChI

InChI=1S/C19H12BrN5OS2/c20-16-8-7-15(28-16)14(26)11-27-19-23-17(12-5-1-3-9-21-12)18(24-25-19)13-6-2-4-10-22-13/h1-10H,11H2