N-phenyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-amine bromide

Systemtic Name: N-phenyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-amine bromide Openeye Name: N-phenyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-amine bromide CAS Name: N-phenyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-amine bromide IUPAC Name: N-phenyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-amine bromide Traditional Name: 4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl(phenyl)amine bromide Formula: C17H14BrN2S- MolecularWeight: 358.27546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)N=C(S2)NC4=CC=CC=C4.[Br-]

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)N=C(S2)NC4=CC=CC=C4.[Br-]

InChI

InChI=1S/C17H14N2S.BrH/c1-2-7-13(8-3-1)18-17-19-16-14-9-5-4-6-12(14)10-11-15(16)20-17;/h1-9H,10-11H2,(H,18,19);1H/p-1