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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=[N+]1CC(=O)N=C2N(N=C(S2)S(=O)(=O)N)C)CC)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=CC(=CC(=[N+]1CC(=O)N=C2N(N=C(S2)S(=O)(=O)N)C)CC)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H24N5O3S2.ClHO4/c1-4-16-11-15(14-9-7-6-8-10-14)12-17(5-2)25(16)13-18(26)22-19-24(3)23-20(29-19)30(21,27)28;2-1(3,4)5/h6-12H,4-5,13H2,1-3H3,(H2,21,27,28);(H,2,3,4,5)/q+1;/p-1