5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-3-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-3-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 5-(5-methyl-3-phenyl-isoxazol-4-yl)-3-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 5-(5-methyl-3-phenyl-4-isoxazolyl)-3-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-3-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 5-(5-methyl-3-phenyl-isoxazol-4-yl)-3-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]-1,2,4-oxadiazole Formula: C18H14N4O3S MolecularWeight: 366.39376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NC(=NO3)CSC4=CC=CC=[N+]4[O-]

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NC(=NO3)CSC4=CC=CC=[N+]4[O-]

InChI

InChI=1S/C18H14N4O3S/c1-12-16(17(21-24-12)13-7-3-2-4-8-13)18-19-14(20-25-18)11-26-15-9-5-6-10-22(15)23/h2-10H,11H2,1H3