2-(2-bromanyl-3-oxidanylidene-butyl)sulfanylethyl-carbamimidoyl-cyano-methyl-azanium

Systemtic Name: 2-(2-bromanyl-3-oxidanylidene-butyl)sulfanylethyl-carbamimidoyl-cyano-methyl-azanium Openeye Name: 2-(2-bromo-3-oxo-butyl)sulfanylethyl-carbamimidoyl-cyano-methyl-ammonium CAS Name: 2-[(2-bromo-3-oxobutyl)thio]ethyl-carbamimidoyl-cyano-methylammonium IUPAC Name: 2-(2-bromo-3-oxobutyl)sulfanylethyl-carbamimidoyl-cyano-methylazanium Traditional Name: amidino-[2-[(2-bromo-3-keto-butyl)thio]ethyl]-cyano-methyl-ammonium Formula: C9H16BrN4OS+ MolecularWeight: 308.21854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CSCC[N+](C)(C#N)C(=N)N)Br

Isomeric SMILES

CC(=O)C(CSCC[N+](C)(C#N)C(=N)N)Br

InChI

InChI=1S/C9H16BrN4OS/c1-7(15)8(10)5-16-4-3-14(2,6-11)9(12)13/h8H,3-5H2,1-2H3,(H3,12,13)/q+1