(1-oxidanidylimidazolidin-1-ium-1-yl) 5-tert-butyl-3-methyl-4-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxylate

Systemtic Name: (1-oxidanidylimidazolidin-1-ium-1-yl) 5-tert-butyl-3-methyl-4-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxylate Openeye Name: (1-oxidoimidazolidin-1-ium-1-yl) 5-tert-butyl-3-methyl-4-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxylate CAS Name: 5-tert-butyl-3-methyl-4-(1,3,4-thiadiazol-2-yl)-2-pyridinecarboxylic acid (1-oxido-1-imidazolidin-1-iumyl) ester IUPAC Name: (1-oxidoimidazolidin-1-ium-1-yl) 5-tert-butyl-3-methyl-4-(1,3,4-thiadiazol-2-yl)pyridine-2-carboxylate Traditional Name: 5-tert-butyl-3-methyl-4-(1,3,4-thiadiazol-2-yl)picolinic acid (1-oxidoimidazolidin-1-ium-1-yl) ester Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN=C1C(=O)O[N+]2(CCNC2)[O-])C(C)(C)C)C3=NN=CS3

Isomeric SMILES

CC1=C(C(=CN=C1C(=O)O[N+]2(CCNC2)[O-])C(C)(C)C)C3=NN=CS3

InChI

InChI=1S/C16H21N5O3S/c1-10-12(14-20-19-9-25-14)11(16(2,3)4)7-18-13(10)15(22)24-21(23)6-5-17-8-21/h7,9,17H,5-6,8H2,1-4H3