5,7-diphenyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-4-ium bromide

Systemtic Name: 5,7-diphenyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-4-ium bromide Openeye Name: 5,7-diphenyl-2,3-dihydrothiazolo[3,2-a]pyrimidin-4-ium bromide CAS Name: 5,7-diphenyl-2,3-dihydrothiazolo[3,2-a]pyrimidin-4-ium bromide IUPAC Name: 5,7-diphenyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-4-ium bromide Traditional Name: 5,7-diphenyl-2,3-dihydrothiazolo[3,2-a]pyrimidin-4-ium bromide Formula: C18H15BrN2S MolecularWeight: 371.2941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=NC(=CC(=[N+]21)C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1CSC2=NC(=CC(=[N+]21)C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C18H15N2S.BrH/c1-3-7-14(8-4-1)16-13-17(15-9-5-2-6-10-15)20-11-12-21-18(20)19-16;/h1-10,13H,11-12H2;1H/q+1;/p-1