2-[(2-nitrophenyl)methylsulfanyl]-1,3-benzothiazole hydrobromide

Systemtic Name: 2-[(2-nitrophenyl)methylsulfanyl]-1,3-benzothiazole hydrobromide Openeye Name: 2-[(2-nitrophenyl)methylsulfanyl]-1,3-benzothiazole hydrobromide CAS Name: 2-[(2-nitrophenyl)methylthio]-1,3-benzothiazole hydrobromide IUPAC Name: 2-[(2-nitrophenyl)methylsulfanyl]-1,3-benzothiazole hydrobromide Traditional Name: 2-[(2-nitrobenzyl)thio]-1,3-benzothiazole hydrobromide Formula: C14H11BrN2O2S2 MolecularWeight: 383.28334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3S2)[N+](=O)[O-].Br

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3S2)[N+](=O)[O-].Br

InChI

InChI=1S/C14H10N2O2S2.BrH/c17-16(18)12-7-3-1-5-10(12)9-19-14-15-11-6-2-4-8-13(11)20-14;/h1-8H,9H2;1H