3-[2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)ethanoylamino]-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 3-[2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)ethanoylamino]-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-[[2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)acetyl]amino]-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-[[2-(2,6-dimethyl-4-phenyl-1-pyridin-1-iumyl)-1-oxoethyl]amino]-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-[[2-(2,6-dimethyl-4-phenylpyridin-1-ium-1-yl)acetyl]amino]-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-[[2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)acetyl]amino]-N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C20H23N6O4S2+ MolecularWeight: 475.56442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1CC(=O)NCCC(=O)NC2=NN=C(S2)S(=O)(=O)N)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=[N+]1CC(=O)NCCC(=O)NC2=NN=C(S2)S(=O)(=O)N)C)C3=CC=CC=C3

InChI

InChI=1S/C20H22N6O4S2/c1-13-10-16(15-6-4-3-5-7-15)11-14(2)26(13)12-18(28)22-9-8-17(27)23-19-24-25-20(31-19)32(21,29)30/h3-7,10-11H,8-9,12H2,1-2H3,(H3-,21,22,23,24,27,28,29,30)/p+1