N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[4-(4-tert-butylphenyl)-2-thiazolyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C[N+](=CC=C3)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C[N+](=CC=C3)[O-]

InChI

InChI=1S/C19H19N3O2S/c1-19(2,3)15-8-6-13(7-9-15)16-12-25-18(20-16)21-17(23)14-5-4-10-22(24)11-14/h4-12H,1-3H3,(H,20,21,23)