2-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(2-sulfamoyl-1,3-benzothiazol-6-yl)ethanamide perchlorate

Systemtic Name: 2-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(2-sulfamoyl-1,3-benzothiazol-6-yl)ethanamide perchlorate Openeye Name: 2-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(2-sulfamoyl-1,3-benzothiazol-6-yl)acetamide perchlorate CAS Name: 2-(2,6-diethyl-4-phenyl-1-pyridin-1-iumyl)-N-(2-sulfamoyl-1,3-benzothiazol-6-yl)acetamide perchlorate IUPAC Name: 2-(2,6-diethyl-4-phenylpyridin-1-ium-1-yl)-N-(2-sulfamoyl-1,3-benzothiazol-6-yl)acetamide perchlorate Traditional Name: 2-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(2-sulfamoyl-1,3-benzothiazol-6-yl)acetamide perchlorate Formula: C24H25ClN4O7S2 MolecularWeight: 581.0609

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=[N+]1CC(=O)NC2=CC3=C(C=C2)N=C(S3)S(=O)(=O)N)CC)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=CC(=CC(=[N+]1CC(=O)NC2=CC3=C(C=C2)N=C(S3)S(=O)(=O)N)CC)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C24H24N4O3S2.ClHO4/c1-3-19-12-17(16-8-6-5-7-9-16)13-20(4-2)28(19)15-23(29)26-18-10-11-21-22(14-18)32-24(27-21)33(25,30)31;2-1(3,4)5/h5-14H,3-4,15H2,1-2H3,(H2-,25,26,29,30,31);(H,2,3,4,5)