5-phenyl-3-(phenylmethyl)-6H-1,3,4-thiadiazin-3-ium-2-amine bromide

Systemtic Name: 5-phenyl-3-(phenylmethyl)-6H-1,3,4-thiadiazin-3-ium-2-amine bromide Openeye Name: 3-benzyl-5-phenyl-6H-1,3,4-thiadiazin-3-ium-2-amine bromide CAS Name: 5-phenyl-3-(phenylmethyl)-6H-1,3,4-thiadiazin-3-ium-2-amine bromide IUPAC Name: 3-benzyl-5-phenyl-6H-1,3,4-thiadiazin-3-ium-2-amine bromide Traditional Name: (3-benzyl-5-phenyl-6H-1,3,4-thiadiazin-3-ium-2-yl)amine bromide Formula: C16H16BrN3S MolecularWeight: 362.28734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=N[N+](=C(S1)N)CC2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

C1C(=N[N+](=C(S1)N)CC2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C16H15N3S.BrH/c17-16-19(11-13-7-3-1-4-8-13)18-15(12-20-16)14-9-5-2-6-10-14;/h1-10,17H,11-12H2;1H