2-(4-chlorophenyl)-4-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,3-oxazole

Systemtic Name: 2-(4-chlorophenyl)-4-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,3-oxazole Openeye Name: 2-(4-chlorophenyl)-4-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]oxazole CAS Name: 2-(4-chlorophenyl)-4-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]oxazole IUPAC Name: 2-(4-chlorophenyl)-4-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-1,3-oxazole Traditional Name: 2-(4-chlorophenyl)-4-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]oxazole Formula: C15H11ClN2O2S MolecularWeight: 318.77804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC2=COC(=N2)C3=CC=C(C=C3)Cl)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC2=COC(=N2)C3=CC=C(C=C3)Cl)[O-]

InChI

InChI=1S/C15H11ClN2O2S/c16-12-6-4-11(5-7-12)15-17-13(9-20-15)10-21-14-3-1-2-8-18(14)19/h1-9H,10H2