N-[(E)-(3-butyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N-ethyl-aniline

Systemtic Name: N-[(E)-(3-butyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N-ethyl-aniline Openeye Name: N-[(E)-(3-butyl-1,3-benzothiazol-3-ium-2-yl)azo]-N-ethyl-aniline CAS Name: N-[(E)-(3-butyl-1,3-benzothiazol-3-ium-2-yl)azo]-N-ethylaniline IUPAC Name: N-[(E)-(3-butyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N-ethylaniline Traditional Name: [(E)-(3-butyl-1,3-benzothiazol-3-ium-2-yl)azo]-ethyl-phenyl-amine Formula: C19H23N4S+ MolecularWeight: 339.47772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(SC2=CC=CC=C21)N=NN(CC)C3=CC=CC=C3

Isomeric SMILES

CCCC[N+]1=C(SC2=CC=CC=C21)/N=N/N(CC)C3=CC=CC=C3

InChI

InChI=1S/C19H23N4S/c1-3-5-15-22-17-13-9-10-14-18(17)24-19(22)20-21-23(4-2)16-11-7-6-8-12-16/h6-14H,3-5,15H2,1-2H3/q+1