6-chloranyl-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine hydrobromide

Systemtic Name: 6-chloranyl-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine hydrobromide Openeye Name: 6-chloro-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine hydrobromide CAS Name: 6-chloro-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine hydrobromide IUPAC Name: 6-chloro-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine hydrobromide Traditional Name: [6-chloro-3-(4-nitrobenzyl)-1,3-benzothiazol-2-ylidene]amine hydrobromide Formula: C14H11BrClN3O2S MolecularWeight: 400.67804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C3=C(C=C(C=C3)Cl)SC2=N)[N+](=O)[O-].Br

Isomeric SMILES

C1=CC(=CC=C1CN2C3=C(C=C(C=C3)Cl)SC2=N)[N+](=O)[O-].Br

InChI

InChI=1S/C14H10ClN3O2S.BrH/c15-10-3-6-12-13(7-10)21-14(16)17(12)8-9-1-4-11(5-2-9)18(19)20;/h1-7,16H,8H2;1H