4-(1,3-benzothiazol-2-ylsulfanyldiazenyl)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyldiazenyl)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylazo)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)azo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyldiazenyl)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)azo-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Formula: C19H16N6O2S3 MolecularWeight: 456.56434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=NSC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=NSC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C19H16N6O2S3/c1-12-11-13(2)21-18(20-12)24-30(26,27)15-9-7-14(8-10-15)23-25-29-19-22-16-5-3-4-6-17(16)28-19/h3-11H,1-2H3,(H,20,21,24)