N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(4-bromanyl-3-nitro-phenyl)methanimine

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(4-bromanyl-3-nitro-phenyl)methanimine Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(4-bromo-3-nitro-phenyl)methanimine CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(4-bromo-3-nitrophenyl)methanimine IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(4-bromo-3-nitrophenyl)methanimine Traditional Name: [4-(1,3-benzothiazol-2-yl)phenyl]-(4-bromo-3-nitro-benzylidene)amine Formula: C20H12BrN3O2S MolecularWeight: 438.29718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)N=CC4=CC(=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)N=CC4=CC(=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C20H12BrN3O2S/c21-16-10-5-13(11-18(16)24(25)26)12-22-15-8-6-14(7-9-15)20-23-17-3-1-2-4-19(17)27-20/h1-12H