(3-bromophenyl) 4-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]benzoate

Systemtic Name: (3-bromophenyl) 4-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]benzoate Openeye Name: (3-bromophenyl) 4-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]benzoate CAS Name: 4-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]benzoic acid (3-bromophenyl) ester IUPAC Name: (3-bromophenyl) 4-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]benzoate Traditional Name: 4-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]benzoic acid (3-bromophenyl) ester Formula: C28H19BrN2O2S MolecularWeight: 527.43166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=CC4=CC=C(C=C4)C(=O)OC5=CC(=CC=C5)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=CC4=CC=C(C=C4)C(=O)OC5=CC(=CC=C5)Br

InChI

InChI=1S/C28H19BrN2O2S/c1-18-5-14-25-26(15-18)34-27(31-25)20-10-12-23(13-11-20)30-17-19-6-8-21(9-7-19)28(32)33-24-4-2-3-22(29)16-24/h2-17H,1H3