2-[3,4-bis(azanyl)quinazolin-3-ium-2-yl]selanyl-1-phenyl-ethanone bromide

Systemtic Name: 2-[3,4-bis(azanyl)quinazolin-3-ium-2-yl]selanyl-1-phenyl-ethanone bromide Openeye Name: 2-(3,4-diaminoquinazolin-3-ium-2-yl)selanyl-1-phenyl-ethanone bromide CAS Name: 2-[(3,4-diamino-2-quinazolin-3-iumyl)seleno]-1-phenylethanone bromide IUPAC Name: 2-(3,4-diaminoquinazolin-3-ium-2-yl)selanyl-1-phenylethanone bromide Traditional Name: 2-[(3,4-diaminoquinazolin-3-ium-2-yl)seleno]-1-phenyl-ethanone bromide Formula: C16H15BrN4OSe MolecularWeight: 438.1805

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[Se]C2=NC3=CC=CC=C3C(=[N+]2N)N.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[Se]C2=NC3=CC=CC=C3C(=[N+]2N)N.[Br-]

InChI

InChI=1S/C16H14N4OSe.BrH/c17-15-12-8-4-5-9-13(12)19-16(20(15)18)22-10-14(21)11-6-2-1-3-7-11;/h1-9,17H,10,18H2;1H