3-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide perchlorate

Systemtic Name: 3-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide perchlorate Openeye Name: 3-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide perchlorate CAS Name: 3-(2,6-diethyl-4-phenyl-1-pyridin-1-iumyl)-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide perchlorate IUPAC Name: 3-(2,6-diethyl-4-phenylpyridin-1-ium-1-yl)-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide perchlorate Traditional Name: 3-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propionamide perchlorate Formula: C20H24ClN5O7S2 MolecularWeight: 546.01686

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=[N+]1CCC(=O)NC2=NN=C(S2)S(=O)(=O)N)CC)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=CC(=CC(=[N+]1CCC(=O)NC2=NN=C(S2)S(=O)(=O)N)CC)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H23N5O3S2.ClHO4/c1-3-16-12-15(14-8-6-5-7-9-14)13-17(4-2)25(16)11-10-18(26)22-19-23-24-20(29-19)30(21,27)28;2-1(3,4)5/h5-9,12-13H,3-4,10-11H2,1-2H3,(H2-,21,22,23,26,27,28);(H,2,3,4,5)