1-(2-nitrophenyl)ethyl carbamimidothioate hydrobromide

Systemtic Name: 1-(2-nitrophenyl)ethyl carbamimidothioate hydrobromide Openeye Name: 2-[1-(2-nitrophenyl)ethyl]isothiourea hydrobromide CAS Name: carbamimidothioic acid 1-(2-nitrophenyl)ethyl ester hydrobromide IUPAC Name: 1-(2-nitrophenyl)ethyl carbamimidothioate hydrobromide Traditional Name: 2-[1-(2-nitrophenyl)ethyl]isothiourea hydrobromide Formula: C9H12BrN3O2S MolecularWeight: 306.17948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1[N+](=O)[O-])SC(=N)N.Br

Isomeric SMILES

CC(C1=CC=CC=C1[N+](=O)[O-])SC(=N)N.Br

InChI

InChI=1S/C9H11N3O2S.BrH/c1-6(15-9(10)11)7-4-2-3-5-8(7)12(13)14;/h2-6H,1H3,(H3,10,11);1H