3-butyl-N-[(2,6-dimethyl-4-nitro-phenyl)diazenyl]-1,3-benzothiazol-2-imine

Systemtic Name: 3-butyl-N-[(2,6-dimethyl-4-nitro-phenyl)diazenyl]-1,3-benzothiazol-2-imine Openeye Name: 3-butyl-N-(2,6-dimethyl-4-nitro-phenyl)azo-1,3-benzothiazol-2-imine CAS Name: 3-butyl-N-(2,6-dimethyl-4-nitrophenyl)azo-1,3-benzothiazol-2-imine IUPAC Name: 3-butyl-N-[(2,6-dimethyl-4-nitrophenyl)diazenyl]-1,3-benzothiazol-2-imine Traditional Name: (Z)-(3-butyl-1,3-benzothiazol-2-ylidene)-(2,6-dimethyl-4-nitro-phenyl)azo-amine Formula: C19H21N5O2S MolecularWeight: 383.46734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2SC1=NN=NC3=C(C=C(C=C3C)[N+](=O)[O-])C

Isomeric SMILES

CCCCN\1C2=CC=CC=C2S/C1=N\N=NC3=C(C=C(C=C3C)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N5O2S/c1-4-5-10-23-16-8-6-7-9-17(16)27-19(23)21-22-20-18-13(2)11-15(24(25)26)12-14(18)3/h6-9,11-12H,4-5,10H2,1-3H3/b21-19-,22-20?