2-(4-methoxyphenyl)-4-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,3-thiazole

Systemtic Name: 2-(4-methoxyphenyl)-4-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 2-(4-methoxyphenyl)-4-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]thiazole CAS Name: 2-(4-methoxyphenyl)-4-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]thiazole IUPAC Name: 2-(4-methoxyphenyl)-4-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 2-(4-methoxyphenyl)-4-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]thiazole Formula: C16H14N2O2S2 MolecularWeight: 330.42456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C16H14N2O2S2/c1-20-14-7-5-12(6-8-14)16-17-13(11-22-16)10-21-15-4-2-3-9-18(15)19/h2-9,11H,10H2,1H3