[azanyl-[(4-cyanophenyl)methylsulfanyl]methylidene]azanium bromide

Systemtic Name: [azanyl-[(4-cyanophenyl)methylsulfanyl]methylidene]azanium bromide Openeye Name: [amino-[(4-cyanophenyl)methylsulfanyl]methylene]ammonium bromide CAS Name: [amino-[(4-cyanophenyl)methylthio]methylidene]ammonium bromide IUPAC Name: [amino-[(4-cyanophenyl)methylsulfanyl]methylidene]azanium bromide Traditional Name: [amino-[(4-cyanobenzyl)thio]methylene]ammonium bromide Formula: C9H10BrN3S MolecularWeight: 272.1648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC(=[NH2+])N)C#N.[Br-]

Isomeric SMILES

C1=CC(=CC=C1CSC(=[NH2+])N)C#N.[Br-]

InChI

InChI=1S/C9H9N3S.BrH/c10-5-7-1-3-8(4-2-7)6-13-9(11)12;/h1-4H,6H2,(H3,11,12);1H