1,3-benzothiazol-2-ylmethyl-[2-[[(1R)-1-(2-bromophenyl)ethyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[2-[[(1R)-1-(2-bromophenyl)ethyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-[[(1R)-1-(2-bromophenyl)ethyl]amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-[[(1R)-1-(2-bromophenyl)ethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-[[(1R)-1-(2-bromophenyl)ethyl]amino]-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-[[(1R)-1-(2-bromophenyl)ethyl]amino]-2-keto-ethyl]-methyl-ammonium Formula: C19H21BrN3OS+ MolecularWeight: 419.35854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NC(=O)C[NH+](C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@H](C1=CC=CC=C1Br)NC(=O)C[NH+](C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H20BrN3OS/c1-13(14-7-3-4-8-15(14)20)21-18(24)11-23(2)12-19-22-16-9-5-6-10-17(16)25-19/h3-10,13H,11-12H2,1-2H3,(H,21,24)/p+1/t13-/m1/s1