N-(5-bromanylpyridin-2-yl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-bromo-2-pyridyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]acetamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide Traditional Name: N-(5-bromo-2-pyridyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]acetamide Formula: C22H16BrN5OS MolecularWeight: 478.36434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC(=O)NC3=NC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC(=O)NC3=NC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H16BrN5OS/c23-17-11-12-18(24-13-17)25-19(29)14-30-22-26-20(15-7-3-1-4-8-15)21(27-28-22)16-9-5-2-6-10-16/h1-13H,14H2,(H,24,25,29)