(E)-[3-(azaniumylmethyl)phenyl]-(1-azanyl-2-methylsulfanyl-ethylidene)azanium dibromide

Systemtic Name: (E)-[3-(azaniumylmethyl)phenyl]-(1-azanyl-2-methylsulfanyl-ethylidene)azanium dibromide Openeye Name: (E)-(1-amino-2-methylsulfanyl-ethylidene)-[3-(azaniumylmethyl)phenyl]ammonium dibromide CAS Name: (E)-[1-amino-2-(methylthio)ethylidene]-[3-(ammoniomethyl)phenyl]ammonium dibromide IUPAC Name: (E)-(1-amino-2-methylsulfanylethylidene)-[3-(azaniumylmethyl)phenyl]azanium dibromide Traditional Name: (E)-[1-amino-2-(methylthio)ethylidene]-[3-(ammoniomethyl)phenyl]ammonium dibromide Formula: C10H17Br2N3S MolecularWeight: 371.13508

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=[NH+]C1=CC=CC(=C1)C[NH3+])N.[Br-].[Br-]

Isomeric SMILES

CSC/C(=[NH+]\C1=CC=CC(=C1)C[NH3+])/N.[Br-].[Br-]

InChI

InChI=1S/C10H15N3S.2BrH/c1-14-7-10(12)13-9-4-2-3-8(5-9)6-11;;/h2-5H,6-7,11H2,1H3,(H2,12,13);2*1H