5-ethyl-4-(1-oxidanidyl-2-propyl-pyridin-1-ium-3-yl)-1,3-thiazole

Systemtic Name: 5-ethyl-4-(1-oxidanidyl-2-propyl-pyridin-1-ium-3-yl)-1,3-thiazole Openeye Name: 5-ethyl-4-(1-oxido-2-propyl-pyridin-1-ium-3-yl)thiazole CAS Name: 5-ethyl-4-(1-oxido-2-propyl-3-pyridin-1-iumyl)thiazole IUPAC Name: 5-ethyl-4-(1-oxido-2-propylpyridin-1-ium-3-yl)-1,3-thiazole Traditional Name: 5-ethyl-4-(1-oxido-2-propyl-pyridin-1-ium-3-yl)thiazole Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=[N+]1[O-])C2=C(SC=N2)CC

Isomeric SMILES

CCCC1=C(C=CC=[N+]1[O-])C2=C(SC=N2)CC

InChI

InChI=1S/C13H16N2OS/c1-3-6-11-10(7-5-8-15(11)16)13-12(4-2)17-9-14-13/h5,7-9H,3-4,6H2,1-2H3