4-bromanyl-N-(5,6-diphenyl-1,2,4-triazin-3-yl)benzamide

Systemtic Name: 4-bromanyl-N-(5,6-diphenyl-1,2,4-triazin-3-yl)benzamide Openeye Name: 4-bromo-N-(5,6-diphenyl-1,2,4-triazin-3-yl)benzamide CAS Name: 4-bromo-N-(5,6-diphenyl-1,2,4-triazin-3-yl)benzamide IUPAC Name: 4-bromo-N-(5,6-diphenyl-1,2,4-triazin-3-yl)benzamide Traditional Name: 4-bromo-N-(5,6-diphenyl-1,2,4-triazin-3-yl)benzamide Formula: C22H15BrN4O MolecularWeight: 431.2847

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H15BrN4O/c23-18-13-11-17(12-14-18)21(28)25-22-24-19(15-7-3-1-4-8-15)20(26-27-22)16-9-5-2-6-10-16/h1-14H,(H,24,25,27,28)